3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine

C72H152F2N10O2 — CID 158027340

IUPAC3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
SMILESCC(C)N1CCC1.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC1CC(C)CN(C(C)C)C1.CC1CCN(C(C)C)CC1.CC1CN(C(C)C)CC(C)O1
InChIInChI=1S/C10H21N.C9H19NO.C9H19N.C8H15F2N.C8H18N2.C8H17N.C7H15NO.C7H15N.C6H13N/c1-8(2)11-6-9(3)5-10(4)7-11;1-7(2)10-5-8(3)11-9(4)6-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)11-5-3-4-8(9,10)6-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)9-6-4-3-5-7-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8;1-6(2)7-4-3-5-7/h8-10H,5-7H2,1-4H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;7H,3-6H2,1-2H3;8H,4-7H2,1-3H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;6H,3-5H2,1-2H3
InChIKeyFGTIXCHBGHFTOO-UHFFFAOYSA-N
MW1228.07 g/mol
LogP13.97
Rot. Bonds9

About 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine

3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine (PubChem CID 158027340) has the molecular formula C72H152F2N10O2 and a molecular weight of 1228.07 g/mol. Its IUPAC name is 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
PubChem CID158027340
Molecular FormulaC72H152F2N10O2
Molecular Weight1228.07 g/mol
Exact Mass1227.21
IUPAC Name3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
SMILESCC(C)N1CCC1.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC1CC(C)CN(C(C)C)C1.CC1CCN(C(C)C)CC1.CC1CN(C(C)C)CC(C)O1
InChIInChI=1S/C10H21N.C9H19NO.C9H19N.C8H15F2N.C8H18N2.C8H17N.C7H15NO.C7H15N.C6H13N/c1-8(2)11-6-9(3)5-10(4)7-11;1-7(2)10-5-8(3)11-9(4)6-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)11-5-3-4-8(9,10)6-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)9-6-4-3-5-7-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8;1-6(2)7-4-3-5-7/h8-10H,5-7H2,1-4H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;7H,3-6H2,1-2H3;8H,4-7H2,1-3H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;6H,3-5H2,1-2H3
InChIKeyFGTIXCHBGHFTOO-UHFFFAOYSA-N
XLogP13.97
TPSA50.86 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds9
Heavy Atoms86
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001228.07
LogP ≤ 513.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The IUPAC name of 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine (CID 158027340) is 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine.
What is the SMILES notation for 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The canonical SMILES for 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine is CC(C)N1CCC1.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC1CC(C)CN(C(C)C)C1.CC1CCN(C(C)C)CC1.CC1CN(C(C)C)CC(C)O1.
What is the InChIKey of 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The InChIKey is FGTIXCHBGHFTOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N.C9H19NO.C9H19N.C8H15F2N.C8H18N2.C8H17N.C7H15NO.C7H15N.C6H13N/c1-8(2)11-6-9(3)5-10(4)7-11;1-7(2)10-5-8(3)11-9(4)6-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)11-5-3-4-8(9,10)6-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)9-6-4-3-5-7-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8;1-6(2)7-4-3-5-7/h8-10H,5-7H2,1-4H3;7-9H,5-6H2,1-4H3;8-9H,4-7H2,1-3H3;7H,3-6H2,1-2H3;8H,4-7H2,1-3H3;8H,3-7H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;6H,3-5H2,1-2H3.
What are the key properties of 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine has a molecular weight of 1228.07 g/mol, XLogP of 13.97, 9 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1-propan-2-ylpiperidine;2,6-dimethyl-4-propan-2-ylmorpholine;3,5-dimethyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine is sourced from PubChem (CID 158027340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).