N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide

C15H23N3O — CID 81485625

IUPACN-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide
SMILESCc1ncccc1C(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C15H23N3O/c1-11-13(8-5-9-17-11)15(19)18-14(10-16)12-6-3-2-4-7-12/h5,8-9,12,14H,2-4,6-7,10,16H2,1H3,(H,18,19)
InChIKeySHUUYGJWQNNBPH-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.03
Rot. Bonds4

About N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide

N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide (PubChem CID 81485625) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide
PubChem CID81485625
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide
SMILESCc1ncccc1C(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C15H23N3O/c1-11-13(8-5-9-17-11)15(19)18-14(10-16)12-6-3-2-4-7-12/h5,8-9,12,14H,2-4,6-7,10,16H2,1H3,(H,18,19)
InChIKeySHUUYGJWQNNBPH-UHFFFAOYSA-N
XLogP2.03
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclohexylethyl)-2-methylbenzamide;hydrochloride
CID 119588952
N-(2-amino-1-cyclopentylethyl)quinoline-5-carboxamide
CID 106737604
N-(2-amino-1-cyclohexylethyl)-2-chlorobenzamide
CID 81487183
N-cyclohexyl-2-methylpyridine-3-carboxamide
CID 78951017
N-(2-amino-1-cyclohexylethyl)-2-iodobenzamide
CID 81487660
N-(2-amino-1-cyclohexylethyl)-2-propan-2-ylsulfonylbenzamide
CID 119591550
N-(2-amino-1-cyclopentylethyl)pyridine-3-carboxamide
CID 106737538
N-(2-amino-1-cyclopropylethyl)quinoline-8-carboxamide;dihydrochloride
CID 119615422
ethyl 2-[(2-amino-1-cyclopentylethyl)amino]pyridine-3-carboxylate
CID 106738180
N-(2-cyclopentyl-2-hydroxyethyl)-2-methylpyridine-3-carboxamide
CID 111425985
N-(2-amino-1-cyclohexylethyl)-2-(propylsulfonylamino)benzamide
CID 119589172
N-(2-amino-1-cyclohexylethyl)-2-methyl-5-nitropyridine-3-carboxamide;hydrochloride
CID 119591180

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide (CID 81485625) is N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide is Cc1ncccc1C(=O)NC(CN)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide?
The InChIKey is SHUUYGJWQNNBPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-13(8-5-9-17-11)15(19)18-14(10-16)12-6-3-2-4-7-12/h5,8-9,12,14H,2-4,6-7,10,16H2,1H3,(H,18,19).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide?
N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 81485625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).