N-(pyridin-2-ylmethyl)cyclohexanamine

C12H18N2 — CID 791938

IUPACN-(pyridin-2-ylmethyl)cyclohexanamine
SMILESc1ccc(CNC2CCCCC2)nc1
InChIInChI=1S/C12H18N2/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13-12/h4-5,8-9,11,14H,1-3,6-7,10H2
InChIKeyKUBDCHSZNMFKFV-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.50
Rot. Bonds3

About N-(pyridin-2-ylmethyl)cyclohexanamine

N-(pyridin-2-ylmethyl)cyclohexanamine (PubChem CID 791938) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N-(pyridin-2-ylmethyl)cyclohexanamine.

Molecular Properties

Compound NameN-(pyridin-2-ylmethyl)cyclohexanamine
PubChem CID791938
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN-(pyridin-2-ylmethyl)cyclohexanamine
SMILESc1ccc(CNC2CCCCC2)nc1
InChIInChI=1S/C12H18N2/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13-12/h4-5,8-9,11,14H,1-3,6-7,10H2
InChIKeyKUBDCHSZNMFKFV-UHFFFAOYSA-N
XLogP2.50
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(pyridin-2-ylmethyl)cyclohexanamine?
The IUPAC name of N-(pyridin-2-ylmethyl)cyclohexanamine (CID 791938) is N-(pyridin-2-ylmethyl)cyclohexanamine.
What is the SMILES notation for N-(pyridin-2-ylmethyl)cyclohexanamine?
The canonical SMILES for N-(pyridin-2-ylmethyl)cyclohexanamine is c1ccc(CNC2CCCCC2)nc1.
What is the InChIKey of N-(pyridin-2-ylmethyl)cyclohexanamine?
The InChIKey is KUBDCHSZNMFKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13-12/h4-5,8-9,11,14H,1-3,6-7,10H2.
What are the key properties of N-(pyridin-2-ylmethyl)cyclohexanamine?
N-(pyridin-2-ylmethyl)cyclohexanamine has a molecular weight of 190.29 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-2-ylmethyl)cyclohexanamine is sourced from PubChem (CID 791938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).