3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine

C15H30N2 — CID 79619372

IUPAC3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine
SMILESCCNC1CCCC(N2CCCC(C)C2C)C1
InChIInChI=1S/C15H30N2/c1-4-16-14-8-5-9-15(11-14)17-10-6-7-12(2)13(17)3/h12-16H,4-11H2,1-3H3
InChIKeyXNPFQZGTKPQVCN-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds3

About 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine

3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine (PubChem CID 79619372) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine.

Molecular Properties

Compound Name3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine
PubChem CID79619372
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine
SMILESCCNC1CCCC(N2CCCC(C)C2C)C1
InChIInChI=1S/C15H30N2/c1-4-16-14-8-5-9-15(11-14)17-10-6-7-12(2)13(17)3/h12-16H,4-11H2,1-3H3
InChIKeyXNPFQZGTKPQVCN-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-3-(2-methylpyrrolidin-1-yl)cyclopentan-1-amine
CID 79644126
3-(2-methylpyrrolidin-1-yl)-N-propylcyclohexan-1-amine
CID 79630966
N-ethyl-3-(4-ethylpiperidin-1-yl)cyclohexan-1-amine
CID 79630874
5-(2,3-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
CID 79860800
cis-(1R,3S)-N-ethyl-3-(4-propan-2-ylpiperazin-1-yl)cyclohexan-1-amine
CID 66634425
N-ethyl-3-(4-methylsulfonylpiperazin-1-yl)cyclohexan-1-amine
CID 79618505
N-ethyl-2,3-dimethyl-1-(3-methylcyclohexyl)piperidin-4-amine
CID 79397999
N-ethyl-3-(3-piperidin-1-ylpyrrolidin-1-yl)cyclohexan-1-amine
CID 79618174
3-N-ethyl-9-N,9-N-dimethyl-9-azabicyclo[3.3.1]nonane-3,9-diamine
CID 83024792
9-cycloheptyl-N-ethyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 55106081
N-ethyl-9-(1-methylpiperidin-3-yl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 62713820
N-ethyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexan-1-amine
CID 79618408

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine?
The IUPAC name of 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine (CID 79619372) is 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine.
What is the SMILES notation for 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine?
The canonical SMILES for 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine is CCNC1CCCC(N2CCCC(C)C2C)C1.
What is the InChIKey of 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine?
The InChIKey is XNPFQZGTKPQVCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-16-14-8-5-9-15(11-14)17-10-6-7-12(2)13(17)3/h12-16H,4-11H2,1-3H3.
What are the key properties of 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine?
3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylpiperidin-1-yl)-N-ethylcyclohexan-1-amine is sourced from PubChem (CID 79619372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).