6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide

C14H20ClN3O — CID 79873055

IUPAC6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide
SMILESCC1(C)CCCCC1NC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C14H20ClN3O/c1-14(2)8-4-3-5-10(14)17-13(19)12-9(15)6-7-11(16)18-12/h6-7,10H,3-5,8H2,1-2H3,(H2,16,18)(H,17,19)
InChIKeyXVKQXGCVKXMQFJ-UHFFFAOYSA-N
MW281.79 g/mol
LogP3.02
Rot. Bonds2

About 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide

6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide (PubChem CID 79873055) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide
PubChem CID79873055
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC Name6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide
SMILESCC1(C)CCCCC1NC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C14H20ClN3O/c1-14(2)8-4-3-5-10(14)17-13(19)12-9(15)6-7-11(16)18-12/h6-7,10H,3-5,8H2,1-2H3,(H2,16,18)(H,17,19)
InChIKeyXVKQXGCVKXMQFJ-UHFFFAOYSA-N
XLogP3.02
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-3-chloro-N-(2-hydroxycyclohexyl)pyridine-2-carboxamide
CID 62358573
3-amino-4-chloro-N-(2,2-dimethylcyclopentyl)benzamide
CID 79855162
6-amino-3-chloro-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 62155799
3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-4-carboxamide
CID 79877759
5-amino-2,3-dichloro-N-(2,2-dimethylcyclohexyl)benzamide
CID 107185521
6-amino-3-chloro-N-(3-methylcyclopentyl)pyridine-2-carboxamide
CID 114540527
3,5-diamino-N-(2,2-dimethylcyclohexyl)benzamide
CID 79855552
6-amino-3-chloro-N-methylpyridine-2-carboxamide
CID 62156050
6-amino-3-chloro-N-(thiolan-3-yl)pyridine-2-carboxamide
CID 103064660
6-amino-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154853
4-amino-N-(2,2-dimethylcyclohexyl)-3,5-difluorobenzamide
CID 79872681
3,6-dichloro-N-(3-hydroxy-2,2-dimethylcyclobutyl)pyridine-2-carboxamide
CID 114629332

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide (CID 79873055) is 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide is CC1(C)CCCCC1NC(=O)c1nc(N)ccc1Cl.
What is the InChIKey of 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide?
The InChIKey is XVKQXGCVKXMQFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O/c1-14(2)8-4-3-5-10(14)17-13(19)12-9(15)6-7-11(16)18-12/h6-7,10H,3-5,8H2,1-2H3,(H2,16,18)(H,17,19).
What are the key properties of 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide?
6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide has a molecular weight of 281.79 g/mol, XLogP of 3.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-2-carboxamide is sourced from PubChem (CID 79873055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).