N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine

C19H24N2 — CID 71881409

IUPACN-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine
SMILESc1ccc(CN(Cc2ccccn2)C2CCCCC2)cc1
InChIInChI=1S/C19H24N2/c1-3-9-17(10-4-1)15-21(19-12-5-2-6-13-19)16-18-11-7-8-14-20-18/h1,3-4,7-11,14,19H,2,5-6,12-13,15-16H2
InChIKeyUDCVRJMIJLULLT-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.42
Rot. Bonds5

About N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine

N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine (PubChem CID 71881409) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine.

Molecular Properties

Compound NameN-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine
PubChem CID71881409
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine
SMILESc1ccc(CN(Cc2ccccn2)C2CCCCC2)cc1
InChIInChI=1S/C19H24N2/c1-3-9-17(10-4-1)15-21(19-12-5-2-6-13-19)16-18-11-7-8-14-20-18/h1,3-4,7-11,14,19H,2,5-6,12-13,15-16H2
InChIKeyUDCVRJMIJLULLT-UHFFFAOYSA-N
XLogP4.42
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N-benzyl-1-N,2-N,2-N-tris(pyridin-2-ylmethyl)cyclohexane-1,2-diamine
CID 91027062
N,N-dibenzylcyclobutanamine
CID 70822586
N-[(1-ethylimidazol-2-yl)methyl]-N-(pyridin-2-ylmethyl)cyclohexanamine
CID 77092740
N'-cyclopentyl-N'-(pyridin-2-ylmethyl)propane-1,3-diamine
CID 43137570
1-N,1-N-bis(pyridin-2-ylmethyl)cyclohexane-1,3-diamine
CID 70873996
N-[(3-methylphenyl)methyl]-N-(pyridin-2-ylmethyl)azepan-4-amine;hydrochloride
CID 129004801
N-benzyl-N-(2-phenylethyl)cyclohexanamine
CID 35215800
2-[[benzylsulfamoyl(cyclohexyl)amino]methyl]pyridine
CID 56871259
N-benzyl-N-bromocyclohexanamine
CID 140997611
2-[[(1R,2R)-2-[bis(carboxymethyl)amino]cyclohexyl]-(pyridin-2-ylmethyl)amino]acetic acid
CID 176507613
4-[[cyclopropyl(2-pyridin-2-ylethyl)amino]methyl]aniline
CID 60892235
N-(1,3-oxazol-4-ylmethyl)-N-(pyridin-2-ylmethyl)azepan-4-amine
CID 120844902

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine?
The IUPAC name of N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine (CID 71881409) is N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine.
What is the SMILES notation for N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine?
The canonical SMILES for N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine is c1ccc(CN(Cc2ccccn2)C2CCCCC2)cc1.
What is the InChIKey of N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine?
The InChIKey is UDCVRJMIJLULLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-3-9-17(10-4-1)15-21(19-12-5-2-6-13-19)16-18-11-7-8-14-20-18/h1,3-4,7-11,14,19H,2,5-6,12-13,15-16H2.
What are the key properties of N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine?
N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine has a molecular weight of 280.42 g/mol, XLogP of 4.42, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine is sourced from PubChem (CID 71881409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).