N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine

C16H32N2 — CID 81391096

IUPACN-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine
SMILESCCN1CCC(N[C@H](C)C2CCCCCC2)CC1
InChIInChI=1S/C16H32N2/c1-3-18-12-10-16(11-13-18)17-14(2)15-8-6-4-5-7-9-15/h14-17H,3-13H2,1-2H3/t14-/m1/s1
InChIKeyOPDKMRGMKYPYJX-CQSZACIVSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds4

About N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine

N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine (PubChem CID 81391096) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine
PubChem CID81391096
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC NameN-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine
SMILESCCN1CCC(N[C@H](C)C2CCCCCC2)CC1
InChIInChI=1S/C16H32N2/c1-3-18-12-10-16(11-13-18)17-14(2)15-8-6-4-5-7-9-15/h14-17H,3-13H2,1-2H3/t14-/m1/s1
InChIKeyOPDKMRGMKYPYJX-CQSZACIVSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-cyclohexylethyl]-1-ethylazepan-4-amine
CID 81384724
N-[(1S)-1-cycloheptylethyl]-1-propylpiperidin-4-amine
CID 81388196
N-(1-cyclohexylethyl)-1-ethylpiperidin-3-amine
CID 61170770
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-[(1S)-1-cyclopentylethyl]-1-methylpiperidin-4-amine
CID 81386748
N-butan-2-yl-1-ethylpiperidin-4-amine
CID 43177306
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
1-[(1-ethylpiperidin-4-yl)methyl]-N-propan-2-ylpiperidin-4-amine;molecular hydrogen
CID 166113030
2-tert-butyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]cyclohexan-1-amine
CID 43673879
ethyl 4-[[(1S)-1-cycloheptylethyl]amino]piperidine-1-carboxylate
CID 81390651
N-[1-(1-ethylpiperidin-4-yl)ethyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 43694255
N-[(1S)-1-cycloheptylethyl]-1-methylpyrrolidin-3-amine
CID 81391420

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine?
The IUPAC name of N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine (CID 81391096) is N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine.
What is the SMILES notation for N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine?
The canonical SMILES for N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine is CCN1CCC(N[C@H](C)C2CCCCCC2)CC1.
What is the InChIKey of N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine?
The InChIKey is OPDKMRGMKYPYJX-CQSZACIVSA-N. The full InChI is InChI=1S/C16H32N2/c1-3-18-12-10-16(11-13-18)17-14(2)15-8-6-4-5-7-9-15/h14-17H,3-13H2,1-2H3/t14-/m1/s1.
What are the key properties of N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine?
N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine is sourced from PubChem (CID 81391096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).