2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine

C15H24N2 — CID 81407298

IUPAC2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine
SMILESCCC1CCCCC1N[C@@H](C)c1cccnc1
InChIInChI=1S/C15H24N2/c1-3-13-7-4-5-9-15(13)17-12(2)14-8-6-10-16-11-14/h6,8,10-13,15,17H,3-5,7,9H2,1-2H3/t12-,13?,15?/m0/s1
InChIKeyYQEBCAFURBHFET-OPFPJEHXSA-N
MW232.37 g/mol
LogP3.70
Rot. Bonds4

About 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine

2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine (PubChem CID 81407298) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine
PubChem CID81407298
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine
SMILESCCC1CCCCC1N[C@@H](C)c1cccnc1
InChIInChI=1S/C15H24N2/c1-3-13-7-4-5-9-15(13)17-12(2)14-8-6-10-16-11-14/h6,8,10-13,15,17H,3-5,7,9H2,1-2H3/t12-,13?,15?/m0/s1
InChIKeyYQEBCAFURBHFET-OPFPJEHXSA-N
XLogP3.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[(1R)-1-pyridin-3-ylethyl]cyclopentan-1-amine
CID 104865522
cis-(1S,2S)-2-ethyl-N-[(1S)-1-phenylethyl]cyclohexan-1-amine
CID 58193955
2-[[(1S)-1-pyridin-3-ylethyl]amino]cyclohexan-1-ol
CID 81404938
trans-(1S,2R)-2-ethyl-N-[(1S)-1-phenylethyl]cyclopentan-1-amine
CID 45095253
trans-(1S,2S)-2-(1-pyridin-3-ylethylamino)cyclopentan-1-ol
CID 102733105
N-(1-pyridin-3-ylethyl)cyclododecanamine
CID 43079395
N-[(1S)-1-pyridin-3-ylethyl]cycloheptanamine
CID 28646604
N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
CID 26385082
4-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cycloheptan-1-amine
CID 81407640
3-[1-[(2-ethylcyclohexyl)amino]ethyl]phenol
CID 43709481
2-ethyl-N-[(1S)-1-(3-fluorophenyl)ethyl]cyclohexan-1-amine
CID 81364942
4-propyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine
CID 28655963

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine?
The IUPAC name of 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine (CID 81407298) is 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine.
What is the SMILES notation for 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine?
The canonical SMILES for 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine is CCC1CCCCC1N[C@@H](C)c1cccnc1.
What is the InChIKey of 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine?
The InChIKey is YQEBCAFURBHFET-OPFPJEHXSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-13-7-4-5-9-15(13)17-12(2)14-8-6-10-16-11-14/h6,8,10-13,15,17H,3-5,7,9H2,1-2H3/t12-,13?,15?/m0/s1.
What are the key properties of 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine?
2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine is sourced from PubChem (CID 81407298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).