3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide

C14H21N3O2 — CID 105063330

IUPAC3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
SMILESCNC1CCC(NC(=O)c2ccncc2OC)CC1
InChIInChI=1S/C14H21N3O2/c1-15-10-3-5-11(6-4-10)17-14(18)12-7-8-16-9-13(12)19-2/h7-11,15H,3-6H2,1-2H3,(H,17,18)
InChIKeyJBSXIKVVQUXDBC-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.35
Rot. Bonds4

About 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide

3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide (PubChem CID 105063330) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
PubChem CID105063330
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
SMILESCNC1CCC(NC(=O)c2ccncc2OC)CC1
InChIInChI=1S/C14H21N3O2/c1-15-10-3-5-11(6-4-10)17-14(18)12-7-8-16-9-13(12)19-2/h7-11,15H,3-6H2,1-2H3,(H,17,18)
InChIKeyJBSXIKVVQUXDBC-UHFFFAOYSA-N
XLogP1.35
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-bromocyclohexyl)-3-methoxypyridine-4-carboxamide
CID 105064552
3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 105063233
N-[(1R,2R)-2-hydroxycyclohexyl]-3-methoxypyridine-4-carboxamide
CID 102739207
N-cyclopropyl-3-(methylamino)pyridine-4-carboxamide
CID 105068162
N-(2-bromocyclopentyl)-3-methoxypyridine-4-carboxamide
CID 105063711
2-methoxy-N-[4-[(2-methoxybenzoyl)amino]cyclohexyl]benzamide
CID 1235931
3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide
CID 105064057
2,3-dimethoxy-N-[4-(methylamino)cyclohexyl]benzamide
CID 43653208
2,6-dimethoxy-N-[4-(methylamino)cyclohexyl]benzamide
CID 43653176
N-cyclopropyl-2,4-dimethoxybenzamide
CID 4576292
cyclobutyl-(3-methoxy-4-pyridinyl)methanone
CID 105065110
2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide
CID 154762622

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide?
The IUPAC name of 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide (CID 105063330) is 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide?
The canonical SMILES for 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide is CNC1CCC(NC(=O)c2ccncc2OC)CC1.
What is the InChIKey of 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide?
The InChIKey is JBSXIKVVQUXDBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-15-10-3-5-11(6-4-10)17-14(18)12-7-8-16-9-13(12)19-2/h7-11,15H,3-6H2,1-2H3,(H,17,18).
What are the key properties of 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide?
3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide is sourced from PubChem (CID 105063330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).