N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide

C20H25N3O — CID 109195297

IUPACN-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide
SMILESCc1ccc(Nc2ccc(C(=O)NC3CCCCCC3)nc2)cc1
InChIInChI=1S/C20H25N3O/c1-15-8-10-17(11-9-15)22-18-12-13-19(21-14-18)20(24)23-16-6-4-2-3-5-7-16/h8-14,16,22H,2-7H2,1H3,(H,23,24)
InChIKeyMKDVVSGNSCHYBI-UHFFFAOYSA-N
MW323.44 g/mol
LogP4.59
Rot. Bonds4

About N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide

N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide (PubChem CID 109195297) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide
PubChem CID109195297
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC NameN-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide
SMILESCc1ccc(Nc2ccc(C(=O)NC3CCCCCC3)nc2)cc1
InChIInChI=1S/C20H25N3O/c1-15-8-10-17(11-9-15)22-18-12-13-19(21-14-18)20(24)23-16-6-4-2-3-5-7-16/h8-14,16,22H,2-7H2,1H3,(H,23,24)
InChIKeyMKDVVSGNSCHYBI-UHFFFAOYSA-N
XLogP4.59
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide 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-(4-acetamidoanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109183029
N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide
CID 109182280
N-cyclopropyl-5-(3,5-dimethylanilino)pyridine-2-carboxamide
CID 109179932
N-cyclohexyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109183016
5-(4-cyanoanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109183058
N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109182282
N-cyclobutyl-5-methylpyridine-2-carboxamide
CID 170056265
N-cyclopropyl-5-(3-methylanilino)pyridine-2-carboxamide
CID 109179924
N-cyclopentyl-5-(2-methylanilino)pyridine-2-carboxamide
CID 109182241
N-cyclopropyl-5-(2,5-dimethylanilino)pyridine-2-carboxamide
CID 109179930
5-(cyclohexylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179840
N-cyclopropyl-5-[4-(dimethylamino)anilino]pyridine-2-carboxamide
CID 109179984

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide?
The IUPAC name of N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide (CID 109195297) is N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide is Cc1ccc(Nc2ccc(C(=O)NC3CCCCCC3)nc2)cc1.
What is the InChIKey of N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide?
The InChIKey is MKDVVSGNSCHYBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-15-8-10-17(11-9-15)22-18-12-13-19(21-14-18)20(24)23-16-6-4-2-3-5-7-16/h8-14,16,22H,2-7H2,1H3,(H,23,24).
What are the key properties of N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide?
N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 4.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109195297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).