3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine

C199H409F17N28O3 — CID 158355162

IUPAC3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine
SMILESCC(C)N1CCC(C(F)(F)F)C1.CC(C)N1CCC(C)(C)C1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCC1C(F)(F)F.CC(C)N1CCCCC1.CC(C)N1CCC[C@@H]1C(F)(F)F.CC(C)N1CCC[C@H](F)C1.CC(C)N1CCC[C@H]1C(F)(F)F.CC(C)N1CCN(C)CC1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](N(C)C)C1.CC1CCCN(C(C)C)C1.CC1CCCN(C(C)C)C1.CC1CCN(C(C)C)C1.CC1CCN(C(C)C)C1.CC1CCN(C(C)C)CC1.CN1CCOCC1.COC1CCCN(C(C)C)C1.COC1CCN(C(C)C)C1
InChIInChI=1S/C10H21N.3C9H20N2.C9H19NO.4C9H19N.4C8H14F3N.2C8H15F2N.C8H16FN.C8H18N2.C8H17NO.5C8H17N.C5H11NO/c1-9(2)11-7-5-6-10(3,4)8-11;3*1-8(2)11-6-5-9(7-11)10(3)4;1-8(2)10-6-4-5-9(7-10)11-3;1-8(2)10-6-5-9(3,4)7-10;1-8(2)10-6-4-9(3)5-7-10;2*1-8(2)10-6-4-5-9(3)7-10;1-6(2)12-4-3-7(5-12)8(9,10)11;3*1-6(2)12-5-3-4-7(12)8(9,10)11;1-7(2)11-5-3-8(9,10)4-6-11;1-7(2)11-5-3-4-8(9,10)6-11;1-7(2)10-5-3-4-8(9)6-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-4-8(6-9)10-3;4*1-7(2)9-5-4-8(3)6-9;1-8(2)9-6-4-3-5-7-9;1-6-2-4-7-5-3-6/h9H,5-8H2,1-4H3;3*8-9H,5-7H2,1-4H3;8-9H,4-7H2,1-3H3;8H,5-7H2,1-4H3;3*8-9H,4-7H2,1-3H3;4*6-7H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;7-8H,3-6H2,1-2H3;8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3;4*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;2-5H2,1H3/t;3*9-;;;;;;;2*7-;;;;8-;;;2*8-;;;;/m.110......10...0..10..../s1
InChIKeyGSUACBLMIHKITJ-GMONUNFOSA-N
MW3565.62 g/mol
LogP41.78
Rot. Bonds28

About 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine

3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine (PubChem CID 158355162) has the molecular formula C199H409F17N28O3 and a molecular weight of 3565.62 g/mol. Its IUPAC name is 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine.

Molecular Properties

Compound Name3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine
PubChem CID158355162
Molecular FormulaC199H409F17N28O3
Molecular Weight3565.62 g/mol
Exact Mass3563.24
IUPAC Name3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine
SMILESCC(C)N1CCC(C(F)(F)F)C1.CC(C)N1CCC(C)(C)C1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCC1C(F)(F)F.CC(C)N1CCCCC1.CC(C)N1CCC[C@@H]1C(F)(F)F.CC(C)N1CCC[C@H](F)C1.CC(C)N1CCC[C@H]1C(F)(F)F.CC(C)N1CCN(C)CC1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](N(C)C)C1.CC1CCCN(C(C)C)C1.CC1CCCN(C(C)C)C1.CC1CCN(C(C)C)C1.CC1CCN(C(C)C)C1.CC1CCN(C(C)C)CC1.CN1CCOCC1.COC1CCCN(C(C)C)C1.COC1CCN(C(C)C)C1
InChIInChI=1S/C10H21N.3C9H20N2.C9H19NO.4C9H19N.4C8H14F3N.2C8H15F2N.C8H16FN.C8H18N2.C8H17NO.5C8H17N.C5H11NO/c1-9(2)11-7-5-6-10(3,4)8-11;3*1-8(2)11-6-5-9(7-11)10(3)4;1-8(2)10-6-4-5-9(7-10)11-3;1-8(2)10-6-5-9(3,4)7-10;1-8(2)10-6-4-9(3)5-7-10;2*1-8(2)10-6-4-5-9(3)7-10;1-6(2)12-4-3-7(5-12)8(9,10)11;3*1-6(2)12-5-3-4-7(12)8(9,10)11;1-7(2)11-5-3-8(9,10)4-6-11;1-7(2)11-5-3-4-8(9,10)6-11;1-7(2)10-5-3-4-8(9)6-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-4-8(6-9)10-3;4*1-7(2)9-5-4-8(3)6-9;1-8(2)9-6-4-3-5-7-9;1-6-2-4-7-5-3-6/h9H,5-8H2,1-4H3;3*8-9H,5-7H2,1-4H3;8-9H,4-7H2,1-3H3;8H,5-7H2,1-4H3;3*8-9H,4-7H2,1-3H3;4*6-7H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;7-8H,3-6H2,1-2H3;8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3;4*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;2-5H2,1H3/t;3*9-;;;;;;;2*7-;;;;8-;;;2*8-;;;;/m.110......10...0..10..../s1
InChIKeyGSUACBLMIHKITJ-GMONUNFOSA-N
XLogP41.78
TPSA118.41 Ų
H-Bond Donors
H-Bond Acceptors31
Rotatable Bonds28
Heavy Atoms247
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003565.62
LogP ≤ 541.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1031

Analyze 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine?
The IUPAC name of 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine (CID 158355162) is 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine.
What is the SMILES notation for 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine?
The canonical SMILES for 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine is CC(C)N1CCC(C(F)(F)F)C1.CC(C)N1CCC(C)(C)C1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCC1C(F)(F)F.CC(C)N1CCCCC1.CC(C)N1CCC[C@@H]1C(F)(F)F.CC(C)N1CCC[C@H](F)C1.CC(C)N1CCC[C@H]1C(F)(F)F.CC(C)N1CCN(C)CC1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1CC[C@@H](N(C)C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](N(C)C)C1.CC1CCCN(C(C)C)C1.CC1CCCN(C(C)C)C1.CC1CCN(C(C)C)C1.CC1CCN(C(C)C)C1.CC1CCN(C(C)C)CC1.CN1CCOCC1.COC1CCCN(C(C)C)C1.COC1CCN(C(C)C)C1.
What is the InChIKey of 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine?
The InChIKey is GSUACBLMIHKITJ-GMONUNFOSA-N. The full InChI is InChI=1S/C10H21N.3C9H20N2.C9H19NO.4C9H19N.4C8H14F3N.2C8H15F2N.C8H16FN.C8H18N2.C8H17NO.5C8H17N.C5H11NO/c1-9(2)11-7-5-6-10(3,4)8-11;3*1-8(2)11-6-5-9(7-11)10(3)4;1-8(2)10-6-4-5-9(7-10)11-3;1-8(2)10-6-5-9(3,4)7-10;1-8(2)10-6-4-9(3)5-7-10;2*1-8(2)10-6-4-5-9(3)7-10;1-6(2)12-4-3-7(5-12)8(9,10)11;3*1-6(2)12-5-3-4-7(12)8(9,10)11;1-7(2)11-5-3-8(9,10)4-6-11;1-7(2)11-5-3-4-8(9,10)6-11;1-7(2)10-5-3-4-8(9)6-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-4-8(6-9)10-3;4*1-7(2)9-5-4-8(3)6-9;1-8(2)9-6-4-3-5-7-9;1-6-2-4-7-5-3-6/h9H,5-8H2,1-4H3;3*8-9H,5-7H2,1-4H3;8-9H,4-7H2,1-3H3;8H,5-7H2,1-4H3;3*8-9H,4-7H2,1-3H3;4*6-7H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;7-8H,3-6H2,1-2H3;8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3;4*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;2-5H2,1H3/t;3*9-;;;;;;;2*7-;;;;8-;;;2*8-;;;;/m.110......10...0..10..../s1.
What are the key properties of 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine?
3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine has a molecular weight of 3565.62 g/mol, XLogP of 41.78, 28 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine is sourced from PubChem (CID 158355162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).