4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine

C92H193F4N13O3 — CID 159467287

IUPAC4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine
SMILESCC(C)C1CCN(C)CC1.CC(C)CN1CC(F)C1.CC(C)CN1CCC(F)(F)CC1.CC(C)CN1CCC(F)CC1.CC(C)CN1CCCC1.CC(C)CN1CCOCC1.CC(C)N1CCCC1.CC(C)N1CCN(C)CC1.CC(C)NC1CCN(C)CC1.CC(C)OC1CCN(C)CC1.CC(C)OCCN1CCCC1
InChIInChI=1S/C9H17F2N.C9H18FN.C9H20N2.2C9H19NO.C9H19N.C8H18N2.C8H17NO.C8H17N.C7H14FN.C7H15N/c1-8(2)7-12-5-3-9(10,11)4-6-12;1-8(2)7-11-5-3-9(10)4-6-11;1-8(2)10-9-4-6-11(3)7-5-9;1-8(2)11-9-4-6-10(3)7-5-9;1-9(2)11-8-7-10-5-3-4-6-10;1-8(2)9-4-6-10(3)7-5-9;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)7-9-5-3-4-6-9;1-6(2)3-9-4-7(8)5-9;1-7(2)8-5-3-4-6-8/h8H,3-7H2,1-2H3;8-9H,3-7H2,1-2H3;8-10H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;9H,3-8H2,1-2H3;8-9H,4-7H2,1-3H3;8H,4-7H2,1-3H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3;6-7H,3-5H2,1-2H3;7H,3-6H2,1-2H3
InChIKeyLVISYOGIHWXTFL-UHFFFAOYSA-N
MW1605.64 g/mol
LogP16.67
Rot. Bonds21

About 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine

4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine (PubChem CID 159467287) has the molecular formula C92H193F4N13O3 and a molecular weight of 1605.64 g/mol. Its IUPAC name is 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine
PubChem CID159467287
Molecular FormulaC92H193F4N13O3
Molecular Weight1605.64 g/mol
Exact Mass1604.53
IUPAC Name4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine
SMILESCC(C)C1CCN(C)CC1.CC(C)CN1CC(F)C1.CC(C)CN1CCC(F)(F)CC1.CC(C)CN1CCC(F)CC1.CC(C)CN1CCCC1.CC(C)CN1CCOCC1.CC(C)N1CCCC1.CC(C)N1CCN(C)CC1.CC(C)NC1CCN(C)CC1.CC(C)OC1CCN(C)CC1.CC(C)OCCN1CCCC1
InChIInChI=1S/C9H17F2N.C9H18FN.C9H20N2.2C9H19NO.C9H19N.C8H18N2.C8H17NO.C8H17N.C7H14FN.C7H15N/c1-8(2)7-12-5-3-9(10,11)4-6-12;1-8(2)7-11-5-3-9(10)4-6-11;1-8(2)10-9-4-6-11(3)7-5-9;1-8(2)11-9-4-6-10(3)7-5-9;1-9(2)11-8-7-10-5-3-4-6-10;1-8(2)9-4-6-10(3)7-5-9;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)7-9-5-3-4-6-9;1-6(2)3-9-4-7(8)5-9;1-7(2)8-5-3-4-6-8/h8H,3-7H2,1-2H3;8-9H,3-7H2,1-2H3;8-10H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;9H,3-8H2,1-2H3;8-9H,4-7H2,1-3H3;8H,4-7H2,1-3H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3;6-7H,3-5H2,1-2H3;7H,3-6H2,1-2H3
InChIKeyLVISYOGIHWXTFL-UHFFFAOYSA-N
XLogP16.67
TPSA78.60 Ų
H-Bond Donors1
H-Bond Acceptors16
Rotatable Bonds21
Heavy Atoms112
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001605.64
LogP ≤ 516.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1016

Analyze 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine?
The IUPAC name of 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine (CID 159467287) is 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine.
What is the SMILES notation for 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine?
The canonical SMILES for 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine is CC(C)C1CCN(C)CC1.CC(C)CN1CC(F)C1.CC(C)CN1CCC(F)(F)CC1.CC(C)CN1CCC(F)CC1.CC(C)CN1CCCC1.CC(C)CN1CCOCC1.CC(C)N1CCCC1.CC(C)N1CCN(C)CC1.CC(C)NC1CCN(C)CC1.CC(C)OC1CCN(C)CC1.CC(C)OCCN1CCCC1.
What is the InChIKey of 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine?
The InChIKey is LVISYOGIHWXTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F2N.C9H18FN.C9H20N2.2C9H19NO.C9H19N.C8H18N2.C8H17NO.C8H17N.C7H14FN.C7H15N/c1-8(2)7-12-5-3-9(10,11)4-6-12;1-8(2)7-11-5-3-9(10)4-6-11;1-8(2)10-9-4-6-11(3)7-5-9;1-8(2)11-9-4-6-10(3)7-5-9;1-9(2)11-8-7-10-5-3-4-6-10;1-8(2)9-4-6-10(3)7-5-9;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)7-9-5-3-4-6-9;1-6(2)3-9-4-7(8)5-9;1-7(2)8-5-3-4-6-8/h8H,3-7H2,1-2H3;8-9H,3-7H2,1-2H3;8-10H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;9H,3-8H2,1-2H3;8-9H,4-7H2,1-3H3;8H,4-7H2,1-3H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3;6-7H,3-5H2,1-2H3;7H,3-6H2,1-2H3.
What are the key properties of 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine?
4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine has a molecular weight of 1605.64 g/mol, XLogP of 16.67, 21 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine is sourced from PubChem (CID 159467287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).