5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide

C22H27N3O2 — CID 109107035

IUPAC5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide
SMILESCc1cc(C)cc(NC(=O)c2cncc(C(=O)NC3CCCCCC3)c2)c1
InChIInChI=1S/C22H27N3O2/c1-15-9-16(2)11-20(10-15)25-22(27)18-12-17(13-23-14-18)21(26)24-19-7-5-3-4-6-8-19/h9-14,19H,3-8H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyKUCULEJMDKBXGH-UHFFFAOYSA-N
MW365.48 g/mol
LogP4.40
Rot. Bonds4

About 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide

5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109107035) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide
PubChem CID109107035
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide
SMILESCc1cc(C)cc(NC(=O)c2cncc(C(=O)NC3CCCCCC3)c2)c1
InChIInChI=1S/C22H27N3O2/c1-15-9-16(2)11-20(10-15)25-22(27)18-12-17(13-23-14-18)21(26)24-19-7-5-3-4-6-8-19/h9-14,19H,3-8H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyKUCULEJMDKBXGH-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 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-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

5-N-cyclopentyl-3-N-(2,4,6-trimethylphenyl)pyridine-3,5-dicarboxamide
CID 109102757
5-N-cyclohexyl-3-N-phenylpyridine-3,5-dicarboxamide
CID 109103063
3-N-cyclopentyl-5-N-cyclopropylpyridine-3,5-dicarboxamide
CID 109101527
4-N-cyclohexyl-2-N-(3,5-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109081429
5-N-cyclopentyl-3-N-(3,4-dichlorophenyl)pyridine-3,5-dicarboxamide
CID 109102814
3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
CID 109103090
N-cyclohexyl-5-(4-methylphenyl)pyridine-3-carboxamide
CID 46032904
5-N-tert-butyl-3-N-cycloheptylpyridine-3,5-dicarboxamide
CID 109106897
N-cycloheptyl-5-(3-methylanilino)pyridine-3-carboxamide
CID 109239507
3-N-(3-chlorophenyl)-5-N-cyclopentylpyridine-3,5-dicarboxamide
CID 109102765
3-N-(4-chloro-2-methylphenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
CID 109103094
5-N-cyclohexyl-3-N-propylpyridine-3,5-dicarboxamide
CID 109101138

Frequently Asked Questions

What is the IUPAC name of 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide (CID 109107035) is 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide is Cc1cc(C)cc(NC(=O)c2cncc(C(=O)NC3CCCCCC3)c2)c1.
What is the InChIKey of 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is KUCULEJMDKBXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-15-9-16(2)11-20(10-15)25-22(27)18-12-17(13-23-14-18)21(26)24-19-7-5-3-4-6-8-19/h9-14,19H,3-8H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide?
5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-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 5-N-cycloheptyl-3-N-(3,5-dimethylphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109107035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).