1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine

C14H26F2N2 — CID 83993171

IUPAC1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine
SMILESCC1CC(NCC(F)F)CN(C2CCCCC2)C1
InChIInChI=1S/C14H26F2N2/c1-11-7-12(17-8-14(15)16)10-18(9-11)13-5-3-2-4-6-13/h11-14,17H,2-10H2,1H3
InChIKeyWHYXJQJZCNFGRW-UHFFFAOYSA-N
MW260.37 g/mol
LogP2.88
Rot. Bonds4

About 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine

1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine (PubChem CID 83993171) has the molecular formula C14H26F2N2 and a molecular weight of 260.37 g/mol. Its IUPAC name is 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine
PubChem CID83993171
Molecular FormulaC14H26F2N2
Molecular Weight260.37 g/mol
Exact Mass260.21
IUPAC Name1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine
SMILESCC1CC(NCC(F)F)CN(C2CCCCC2)C1
InChIInChI=1S/C14H26F2N2/c1-11-7-12(17-8-14(15)16)10-18(9-11)13-5-3-2-4-6-13/h11-14,17H,2-10H2,1H3
InChIKeyWHYXJQJZCNFGRW-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.37
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-5-methyl-N-(2-methylpropyl)piperidin-3-amine
CID 83994516
methyl 1-cyclopentyl-5-(2,2-difluoroethylamino)piperidine-3-carboxylate
CID 83993140
2-[1-cyclopentyl-5-(2,2-difluoroethylamino)piperidin-3-yl]acetic acid
CID 83993142
1-cyclobutyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
CID 83997328
1-[1-cyclopropyl-5-(2,2-difluoroethylamino)piperidin-3-yl]ethanol
CID 83993163
1-cyclopropyl-5-(cyclopropylmethyl)-N-(2,2-difluoroethyl)piperidin-3-amine
CID 83993151
1-cyclopropyl-5-methyl-N-(3-methylbutyl)piperidin-3-amine
CID 83995913
1-cyclohexyl-5-ethyl-N-(2-methylpropyl)piperidin-3-amine
CID 83994555
1-(1-cyclopropylethyl)-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine
CID 83993235
trans-(1S,3S)-N-(2,2-difluoroethyl)-3-methylcyclopentan-1-amine
CID 162591470
1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine
CID 83994520
2-[3-(2,2-difluoroethylamino)-5-methylpiperidin-1-yl]ethanol
CID 83993383

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine?
The IUPAC name of 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine (CID 83993171) is 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine.
What is the SMILES notation for 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine?
The canonical SMILES for 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine is CC1CC(NCC(F)F)CN(C2CCCCC2)C1.
What is the InChIKey of 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine?
The InChIKey is WHYXJQJZCNFGRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F2N2/c1-11-7-12(17-8-14(15)16)10-18(9-11)13-5-3-2-4-6-13/h11-14,17H,2-10H2,1H3.
What are the key properties of 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine?
1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine has a molecular weight of 260.37 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(2,2-difluoroethyl)-5-methylpiperidin-3-amine is sourced from PubChem (CID 83993171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).