4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide

C22H27N3O2 — CID 109089379

IUPAC4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1cccc(NC(=O)c2cc(C(=O)NC3CCCCCC3)ccn2)c1C
InChIInChI=1S/C22H27N3O2/c1-15-8-7-11-19(16(15)2)25-22(27)20-14-17(12-13-23-20)21(26)24-18-9-5-3-4-6-10-18/h7-8,11-14,18H,3-6,9-10H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyQICGJZJEUIKFHB-UHFFFAOYSA-N
MW365.48 g/mol
LogP4.40
Rot. Bonds4

About 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide

4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109089379) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109089379
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1cccc(NC(=O)c2cc(C(=O)NC3CCCCCC3)ccn2)c1C
InChIInChI=1S/C22H27N3O2/c1-15-8-7-11-19(16(15)2)25-22(27)20-14-17(12-13-23-20)21(26)24-18-9-5-3-4-6-10-18/h7-8,11-14,18H,3-6,9-10H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyQICGJZJEUIKFHB-UHFFFAOYSA-N
XLogP4.40
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide 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

2-N-cycloheptyl-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109089442
4-N-cyclohexyl-2-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109081436
2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092030
N-cyclopentyl-4-(2,3-dimethylanilino)pyridine-2-carboxamide
CID 109204081
4-N-cyclohexyl-2-N-(3,5-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109081429
4-N-(2-chlorophenyl)-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092151
4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide
CID 109081597
4-N-(5-chloro-2-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080959
4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 109201977
4-N-cyclopentyl-2-N-(2,6-dichlorophenyl)pyridine-2,4-dicarboxamide
CID 109080842
4-N-(4-chloro-2-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080960
N-(2,3-dimethylphenyl)-4-(2-ethylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090150

Frequently Asked Questions

What is the IUPAC name of 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide (CID 109089379) is 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide is Cc1cccc(NC(=O)c2cc(C(=O)NC3CCCCCC3)ccn2)c1C.
What is the InChIKey of 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is QICGJZJEUIKFHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-15-8-7-11-19(16(15)2)25-22(27)20-14-17(12-13-23-20)21(26)24-18-9-5-3-4-6-10-18/h7-8,11-14,18H,3-6,9-10H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide?
4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 365.48 g/mol, XLogP of 4.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109089379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).