2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide

C15H16ClN3O — CID 114921441

IUPAC2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1cc(N)ncc1Cl
InChIInChI=1S/C15H16ClN3O/c1-3-10-6-4-5-9(2)14(10)19-15(20)11-7-13(17)18-8-12(11)16/h4-8H,3H2,1-2H3,(H2,17,18)(H,19,20)
InChIKeyXJOVBUUTHRPENW-UHFFFAOYSA-N
MW289.77 g/mol
LogP3.44
Rot. Bonds3

About 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide

2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide (PubChem CID 114921441) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
PubChem CID114921441
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC Name2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1cc(N)ncc1Cl
InChIInChI=1S/C15H16ClN3O/c1-3-10-6-4-5-9(2)14(10)19-15(20)11-7-13(17)18-8-12(11)16/h4-8H,3H2,1-2H3,(H2,17,18)(H,19,20)
InChIKeyXJOVBUUTHRPENW-UHFFFAOYSA-N
XLogP3.44
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-(2-ethyl-6-methylphenyl)pyridine-3-carboxamide
CID 62153379
2,4-dichloro-N-(2-ethyl-6-methylphenyl)benzamide
CID 779360
4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide
CID 62153378
2-amino-6-chloro-N-(2-ethyl-6-methylphenyl)benzamide
CID 63659820
2-chloro-N-(2-ethyl-6-methylphenyl)-5-(methanesulfonamido)benzamide
CID 46770786
N-(2-ethyl-6-methylphenyl)-5-methylpyrazine-2-carboxamide
CID 8761786
2-amino-5-chloro-N-(2-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 114923980
2-amino-5-chloro-N-naphthalen-1-ylpyridine-4-carboxamide
CID 114921449
N-(2-ethyl-6-methylphenyl)-2,4,5-trimethoxybenzamide
CID 2665532
2-amino-5-chloro-N-(4-propylphenyl)pyridine-4-carboxamide
CID 114922194
3-chloro-N-(2-ethyl-6-methylphenyl)-4-methoxybenzamide
CID 960097
8-chloro-N-(2-ethyl-6-methylphenyl)-2-oxochromene-3-carboxamide
CID 100794759

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide (CID 114921441) is 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide is CCc1cccc(C)c1NC(=O)c1cc(N)ncc1Cl.
What is the InChIKey of 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide?
The InChIKey is XJOVBUUTHRPENW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-3-10-6-4-5-9(2)14(10)19-15(20)11-7-13(17)18-8-12(11)16/h4-8H,3H2,1-2H3,(H2,17,18)(H,19,20).
What are the key properties of 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide?
2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide has a molecular weight of 289.77 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 114921441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).