N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide

C15H23N3O — CID 55047491

IUPACN-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccnc(C(=O)N(C)CC2CCCCC2)c1
InChIInChI=1S/C15H23N3O/c1-16-13-8-9-17-14(10-13)15(19)18(2)11-12-6-4-3-5-7-12/h8-10,12H,3-7,11H2,1-2H3,(H,16,17)
InChIKeyIOMSRBHXRSZFJS-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.78
Rot. Bonds4

About N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide

N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide (PubChem CID 55047491) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide
PubChem CID55047491
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccnc(C(=O)N(C)CC2CCCCC2)c1
InChIInChI=1S/C15H23N3O/c1-16-13-8-9-17-14(10-13)15(19)18(2)11-12-6-4-3-5-7-12/h8-10,12H,3-7,11H2,1-2H3,(H,16,17)
InChIKeyIOMSRBHXRSZFJS-UHFFFAOYSA-N
XLogP2.78
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-N-(cyclohexylmethyl)-N-methylpyridine-2-carboxamide
CID 115117058
N-(cyclohexylmethyl)-4-(methylamino)pyridine-2-carboxamide
CID 62169507
N-cyclohexyl-N-ethyl-4-(methylamino)pyridine-2-carboxamide
CID 62167410
N-methyl-4-(methylamino)-N-propylpyridine-2-carboxamide
CID 62170346
4-(cyclopentylmethylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43517479
N-(cyclobutylmethyl)-N-methyl-3-(methylamino)benzamide
CID 115160920
N-(cyclohexylmethyl)-2-hydrazinyl-N-methylpyridine-4-carboxamide
CID 62244049
N-methyl-4-(methylamino)-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 55042558
N-methyl-4-(methylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide
CID 62179582
N-ethyl-4-(methylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 62179439
6-[cyclohexylmethyl(methyl)carbamoyl]pyridine-2-carboxylic acid
CID 61444061
N-cycloheptyl-4-hydrazinyl-N-methylpyridine-2-carboxamide
CID 62236519

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide (CID 55047491) is N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide is CNc1ccnc(C(=O)N(C)CC2CCCCC2)c1.
What is the InChIKey of N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide?
The InChIKey is IOMSRBHXRSZFJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-16-13-8-9-17-14(10-13)15(19)18(2)11-12-6-4-3-5-7-12/h8-10,12H,3-7,11H2,1-2H3,(H,16,17).
What are the key properties of N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide?
N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N-methyl-4-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 55047491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).