3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide

C10H14ClN3O2 — CID 140754648

IUPAC3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
SMILESCC(C)(O)CNC(=O)c1ncc(Cl)cc1N
InChIInChI=1S/C10H14ClN3O2/c1-10(2,16)5-14-9(15)8-7(12)3-6(11)4-13-8/h3-4,16H,5,12H2,1-2H3,(H,14,15)
InChIKeyXQVFKWCMZGQACY-UHFFFAOYSA-N
MW243.69 g/mol
LogP0.82
Rot. Bonds3

About 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide

3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide (PubChem CID 140754648) has the molecular formula C10H14ClN3O2 and a molecular weight of 243.69 g/mol. Its IUPAC name is 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
PubChem CID140754648
Molecular FormulaC10H14ClN3O2
Molecular Weight243.69 g/mol
Exact Mass243.08
IUPAC Name3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
SMILESCC(C)(O)CNC(=O)c1ncc(Cl)cc1N
InChIInChI=1S/C10H14ClN3O2/c1-10(2,16)5-14-9(15)8-7(12)3-6(11)4-13-8/h3-4,16H,5,12H2,1-2H3,(H,14,15)
InChIKeyXQVFKWCMZGQACY-UHFFFAOYSA-N
XLogP0.82
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.69
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-N-(2-hydroxy-2-methylpropyl)pyrimidine-4-carboxamide;5-aminopyrimidine-4-carboxylic acid
CID 159466593
2-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)benzamide
CID 65103861
2,5-dichloro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 114918592
(2S,3R)-2-[(3-amino-5-chloropyridine-2-carbonyl)amino]-3-[(2-methylpropan-2-yl)oxy]butanoic acid
CID 141145801
4-amino-1-ethyl-N-(2-hydroxy-2-methylpropyl)pyrazole-3-carboxamide
CID 65363321
2,4-dichloro-N-(2-hydroxy-2-methylpropyl)benzamide
CID 65109953
3-amino-5-chloropyridine-2-carbohydrazide;4-chloro-5-(trifluoromethyl)cyclohepta-2,4,6-triene-1-thiol;methanol
CID 143610173
4-amino-N-(2-hydroxy-2-methylpropyl)-3-methoxybenzamide
CID 104783008
3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide
CID 104742439
2-amino-4,6-difluoro-N-(2-hydroxy-2-methylpropyl)benzamide
CID 70098730
N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 65109884
5-bromo-3-chloro-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
CID 70896660

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide (CID 140754648) is 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide is CC(C)(O)CNC(=O)c1ncc(Cl)cc1N.
What is the InChIKey of 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide?
The InChIKey is XQVFKWCMZGQACY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O2/c1-10(2,16)5-14-9(15)8-7(12)3-6(11)4-13-8/h3-4,16H,5,12H2,1-2H3,(H,14,15).
What are the key properties of 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide?
3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide has a molecular weight of 243.69 g/mol, XLogP of 0.82, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-chloro-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 140754648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).