2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide

C17H16ClN3O2 — CID 109078521

IUPAC2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1cc(C(=O)NC2CC2)ccn1
InChIInChI=1S/C17H16ClN3O2/c1-10-8-12(18)2-5-14(10)21-17(23)15-9-11(6-7-19-15)16(22)20-13-3-4-13/h2,5-9,13H,3-4H2,1H3,(H,20,22)(H,21,23)
InChIKeyBBGUUJLOSVHPRB-UHFFFAOYSA-N
MW329.79 g/mol
LogP3.19
Rot. Bonds4

About 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide

2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide (PubChem CID 109078521) has the molecular formula C17H16ClN3O2 and a molecular weight of 329.79 g/mol. Its IUPAC name is 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide
PubChem CID109078521
Molecular FormulaC17H16ClN3O2
Molecular Weight329.79 g/mol
Exact Mass329.09
IUPAC Name2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1cc(C(=O)NC2CC2)ccn1
InChIInChI=1S/C17H16ClN3O2/c1-10-8-12(18)2-5-14(10)21-17(23)15-9-11(6-7-19-15)16(22)20-13-3-4-13/h2,5-9,13H,3-4H2,1H3,(H,20,22)(H,21,23)
InChIKeyBBGUUJLOSVHPRB-UHFFFAOYSA-N
XLogP3.19
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.79
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(4-chloro-2-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080960
4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide
CID 109081597
4-N-(5-chloro-2-methylphenyl)-2-N-cyclopropylpyridine-2,4-dicarboxamide
CID 109078715
4-N-(5-chloro-2-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080959
2-N-(3-chloro-4-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide
CID 109078522
2-N-cyclohexyl-4-N-(2,4-dichlorophenyl)pyridine-2,4-dicarboxamide
CID 109081635
2-N-(5-chloro-2-methoxyphenyl)-4-N-cyclohexylpyridine-2,4-dicarboxamide
CID 109081455
3-N-(4-chloro-2-methylphenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
CID 109103094
N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090311
4-(4-chloro-2-methylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204837
4-N-butan-2-yl-2-N-(4-chloro-2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109080050
4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109089379

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide (CID 109078521) is 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide is Cc1cc(Cl)ccc1NC(=O)c1cc(C(=O)NC2CC2)ccn1.
What is the InChIKey of 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide?
The InChIKey is BBGUUJLOSVHPRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN3O2/c1-10-8-12(18)2-5-14(10)21-17(23)15-9-11(6-7-19-15)16(22)20-13-3-4-13/h2,5-9,13H,3-4H2,1H3,(H,20,22)(H,21,23).
What are the key properties of 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide?
2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide has a molecular weight of 329.79 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109078521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).