5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide

C14H21N3O — CID 81316470

IUPAC5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide
SMILESCC1CC(C)CC(NC(=O)c2ccc(N)cn2)C1
InChIInChI=1S/C14H21N3O/c1-9-5-10(2)7-12(6-9)17-14(18)13-4-3-11(15)8-16-13/h3-4,8-10,12H,5-7,15H2,1-2H3,(H,17,18)
InChIKeyNGMGICXFWXTMTE-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.22
Rot. Bonds2

About 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide

5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide (PubChem CID 81316470) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide
PubChem CID81316470
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide
SMILESCC1CC(C)CC(NC(=O)c2ccc(N)cn2)C1
InChIInChI=1S/C14H21N3O/c1-9-5-10(2)7-12(6-9)17-14(18)13-4-3-11(15)8-16-13/h3-4,8-10,12H,5-7,15H2,1-2H3,(H,17,18)
InChIKeyNGMGICXFWXTMTE-UHFFFAOYSA-N
XLogP2.22
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(3-methylcyclobutyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120689052
5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 81317228
5-hydrazinyl-N-(3-methylcyclopentyl)pyridine-2-carboxamide
CID 114541026
N-(4-acetamidophenyl)-5-aminopyridine-2-carboxamide
CID 81319300
3-amino-N-(3,5-dimethylcyclohexyl)benzamide
CID 64733610
N-(3,5-dimethylcyclohexyl)-4-(methylamino)pyridine-2-carboxamide
CID 64733335
(5-amino-2-pyridinyl)-(4-methylcyclohexyl)methanone
CID 116605314
5-amino-N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyridine-2-carboxamide
CID 81316686
N-(1-adamantyl)-5-aminopyridine-2-carboxamide
CID 81309951
4-amino-N-(3,5-dimethylcyclohexyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 64733030
5-amino-N-(cyclopropylmethyl)pyridine-2-carboxamide
CID 81319676
6-[(3-methylcyclobutyl)carbamoyl]pyridine-2-carboxylic acid
CID 115910448

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide (CID 81316470) is 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide is CC1CC(C)CC(NC(=O)c2ccc(N)cn2)C1.
What is the InChIKey of 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide?
The InChIKey is NGMGICXFWXTMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-9-5-10(2)7-12(6-9)17-14(18)13-4-3-11(15)8-16-13/h3-4,8-10,12H,5-7,15H2,1-2H3,(H,17,18).
What are the key properties of 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide?
5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide is sourced from PubChem (CID 81316470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).