5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide

C14H20ClN3O2 — CID 83039415

IUPAC5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)NC2CCOC(C)(C)C2)cc1Cl
InChIInChI=1S/C14H20ClN3O2/c1-14(2)7-10(4-5-20-14)18-13(19)9-6-11(15)12(16-3)17-8-9/h6,8,10H,4-5,7H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyNCZCTPJJBLIYOW-UHFFFAOYSA-N
MW297.79 g/mol
LogP2.46
Rot. Bonds3

About 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide

5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide (PubChem CID 83039415) has the molecular formula C14H20ClN3O2 and a molecular weight of 297.79 g/mol. Its IUPAC name is 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide
PubChem CID83039415
Molecular FormulaC14H20ClN3O2
Molecular Weight297.79 g/mol
Exact Mass297.12
IUPAC Name5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)NC2CCOC(C)(C)C2)cc1Cl
InChIInChI=1S/C14H20ClN3O2/c1-14(2)7-10(4-5-20-14)18-13(19)9-6-11(15)12(16-3)17-8-9/h6,8,10H,4-5,7H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyNCZCTPJJBLIYOW-UHFFFAOYSA-N
XLogP2.46
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.79
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-amino-5-chloro-N-(2,2-dimethyloxan-4-yl)pyridine-3-carboxamide
CID 115563972
5-chloro-6-(methylamino)-N-(4-methylcyclohexyl)pyridine-3-carboxamide
CID 55042305
5-chloro-N-(3-methoxycyclobutyl)-6-(methylamino)pyridine-3-carboxamide
CID 114120797
3,5-dichloro-N-(2,2-dimethyloxan-4-yl)pyridine-4-carboxamide
CID 122132655
N-(2,2-dimethyloxan-4-yl)-5-(methylamino)pyridine-2-carboxamide
CID 104641994
2-chloro-N-(2,2-dimethyloxan-4-yl)-6-methylpyridine-4-carboxamide
CID 113378498
5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide
CID 62409249
5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide
CID 55063853
3-chloro-N-(2,2-dimethyloxan-4-yl)pyridine-4-carboxamide
CID 113336639
6-azido-N-[(4R)-2,2-dimethyloxan-4-yl]pyridine-3-carboxamide
CID 98893292
5,6-dichloro-N-(3,3-dimethylcyclopentyl)pyridine-3-carboxamide
CID 113345464
5-(3-aminoprop-1-ynyl)-N-(2,2-dimethyloxan-4-yl)pyridine-3-carboxamide
CID 83035251

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide (CID 83039415) is 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide is CNc1ncc(C(=O)NC2CCOC(C)(C)C2)cc1Cl.
What is the InChIKey of 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide?
The InChIKey is NCZCTPJJBLIYOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O2/c1-14(2)7-10(4-5-20-14)18-13(19)9-6-11(15)12(16-3)17-8-9/h6,8,10H,4-5,7H2,1-3H3,(H,16,17)(H,18,19).
What are the key properties of 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide?
5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide has a molecular weight of 297.79 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 83039415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).