N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine

C15H24N2 — CID 81027798

IUPACN-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine
SMILESCC(C)NCC1CCCCC1c1cccnc1
InChIInChI=1S/C15H24N2/c1-12(2)17-11-14-6-3-4-8-15(14)13-7-5-9-16-10-13/h5,7,9-10,12,14-15,17H,3-4,6,8,11H2,1-2H3
InChIKeyLJTLFYAJOVQLQH-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.35
Rot. Bonds4

About N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine

N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine (PubChem CID 81027798) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine
PubChem CID81027798
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine
SMILESCC(C)NCC1CCCCC1c1cccnc1
InChIInChI=1S/C15H24N2/c1-12(2)17-11-14-6-3-4-8-15(14)13-7-5-9-16-10-13/h5,7,9-10,12,14-15,17H,3-4,6,8,11H2,1-2H3
InChIKeyLJTLFYAJOVQLQH-UHFFFAOYSA-N
XLogP3.35
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 ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
CID 81018367
N-[(2-pyrazin-2-ylcycloheptyl)methyl]propan-2-amine
CID 81025607
[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine
CID 138571732
2-(2-pyridin-3-ylcyclohexyl)acetonitrile
CID 82241256
N-[[2-(5-fluoro-3-pyridinyl)cyclopentyl]methyl]propan-2-amine
CID 81034048
methyl 2-(2-pyridin-3-ylcycloheptyl)acetate
CID 82244502
N-[[2-(4-cyclobutylphenyl)cyclohexyl]methyl]propan-2-amine
CID 116507110
N-[(2-pyrazin-2-ylcyclopentyl)methyl]propan-2-amine
CID 81033718
N-[[2-(3,4-dichlorophenyl)cyclohexyl]methyl]propan-2-amine
CID 81024326
N-[[2-(1-methylpyrazol-4-yl)cyclopentyl]methyl]propan-2-amine
CID 81034337
N-ethyl-2-pyridin-3-ylcycloheptan-1-amine
CID 62604063
N-[[2-(1-ethylpyrazol-4-yl)cycloheptyl]methyl]propan-2-amine
CID 81025706

Frequently Asked Questions

What is the IUPAC name of N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine?
The IUPAC name of N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine (CID 81027798) is N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine.
What is the SMILES notation for N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine?
The canonical SMILES for N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine is CC(C)NCC1CCCCC1c1cccnc1.
What is the InChIKey of N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine?
The InChIKey is LJTLFYAJOVQLQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12(2)17-11-14-6-3-4-8-15(14)13-7-5-9-16-10-13/h5,7,9-10,12,14-15,17H,3-4,6,8,11H2,1-2H3.
What are the key properties of N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine?
N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine has a molecular weight of 232.37 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine is sourced from PubChem (CID 81027798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).