2-(1-pyridin-3-ylcyclohexyl)ethanamine

C13H20N2 — CID 83819763

IUPAC2-(1-pyridin-3-ylcyclohexyl)ethanamine
SMILESNCCC1(c2cccnc2)CCCCC1
InChIInChI=1S/C13H20N2/c14-9-8-13(6-2-1-3-7-13)12-5-4-10-15-11-12/h4-5,10-11H,1-3,6-9,14H2
InChIKeyZJGZXBZJOVUIOB-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.63
Rot. Bonds3

About 2-(1-pyridin-3-ylcyclohexyl)ethanamine

2-(1-pyridin-3-ylcyclohexyl)ethanamine (PubChem CID 83819763) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 2-(1-pyridin-3-ylcyclohexyl)ethanamine.

Molecular Properties

Compound Name2-(1-pyridin-3-ylcyclohexyl)ethanamine
PubChem CID83819763
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name2-(1-pyridin-3-ylcyclohexyl)ethanamine
SMILESNCCC1(c2cccnc2)CCCCC1
InChIInChI=1S/C13H20N2/c14-9-8-13(6-2-1-3-7-13)12-5-4-10-15-11-12/h4-5,10-11H,1-3,6-9,14H2
InChIKeyZJGZXBZJOVUIOB-UHFFFAOYSA-N
XLogP2.63
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(1-pyridin-3-ylcyclohexyl)methyl]propan-1-amine
CID 80522632
N-methyl-1-(1-pyridin-3-ylcyclobutyl)methanamine
CID 80522291
(4-pyridin-3-ylpiperidin-4-yl)methanamine
CID 80522475
2-(1-pyridin-2-ylcycloheptyl)ethanamine
CID 83821963
2-[1-(4-methylphenyl)cyclohexyl]ethanamine
CID 82079127
2,3-bis[(1-pyridin-3-ylcyclopentyl)methyl]benzamide
CID 151541891
3-(1-fluorocyclobutyl)pyridine
CID 158766896
3-(aminomethyl)-3-pyridin-3-ylpyrrolidin-2-one
CID 83530805
2-[1-(3,5-difluorophenyl)cyclopentyl]ethanamine
CID 83823340
ethane;3-(1-methylcyclobutyl)pyridine
CID 142353863
(2,2-dimethyl-1-pyridin-3-ylcyclopropyl)methanamine
CID 83481940
2-[1-(2-methylphenyl)cyclohexyl]ethanamine
CID 82079125

Frequently Asked Questions

What is the IUPAC name of 2-(1-pyridin-3-ylcyclohexyl)ethanamine?
The IUPAC name of 2-(1-pyridin-3-ylcyclohexyl)ethanamine (CID 83819763) is 2-(1-pyridin-3-ylcyclohexyl)ethanamine.
What is the SMILES notation for 2-(1-pyridin-3-ylcyclohexyl)ethanamine?
The canonical SMILES for 2-(1-pyridin-3-ylcyclohexyl)ethanamine is NCCC1(c2cccnc2)CCCCC1.
What is the InChIKey of 2-(1-pyridin-3-ylcyclohexyl)ethanamine?
The InChIKey is ZJGZXBZJOVUIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c14-9-8-13(6-2-1-3-7-13)12-5-4-10-15-11-12/h4-5,10-11H,1-3,6-9,14H2.
What are the key properties of 2-(1-pyridin-3-ylcyclohexyl)ethanamine?
2-(1-pyridin-3-ylcyclohexyl)ethanamine has a molecular weight of 204.32 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-pyridin-3-ylcyclohexyl)ethanamine is sourced from PubChem (CID 83819763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).