N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide

C16H17N3O — CID 115268637

IUPACN-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(NC3CC3)nc2)c1
InChIInChI=1S/C16H17N3O/c1-11-3-2-4-12(9-11)16(20)19-14-7-8-15(17-10-14)18-13-5-6-13/h2-4,7-10,13H,5-6H2,1H3,(H,17,18)(H,19,20)
InChIKeySVXIEVSNWGXZOS-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.22
Rot. Bonds4

About N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide

N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide (PubChem CID 115268637) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide.

Molecular Properties

Compound NameN-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide
PubChem CID115268637
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC NameN-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(NC3CC3)nc2)c1
InChIInChI=1S/C16H17N3O/c1-11-3-2-4-12(9-11)16(20)19-14-7-8-15(17-10-14)18-13-5-6-13/h2-4,7-10,13H,5-6H2,1H3,(H,17,18)(H,19,20)
InChIKeySVXIEVSNWGXZOS-UHFFFAOYSA-N
XLogP3.22
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide 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

N-[6-(cyclohexylamino)-3-pyridinyl]-3-methylbenzamide
CID 113010050
N-[6-(cycloheptylamino)-3-pyridinyl]-3-methoxybenzamide
CID 113014907
N-[6-(3,5-dichloroanilino)-3-pyridinyl]-3-methylbenzamide
CID 113022321
3-methyl-N-[5-(3-methylanilino)-2-pyridinyl]benzamide
CID 113031421
N-[6-(2-bromo-4-methylanilino)-3-pyridinyl]-3-methylbenzamide
CID 113021470
N-[6-(cyclohexylamino)-3-pyridinyl]-3,4-dimethoxybenzamide
CID 113010066
N-[6-(4-bromo-2-methylanilino)-3-pyridinyl]-3-methylbenzamide
CID 113021502
N-[5-(3-acetylanilino)-2-pyridinyl]-3-methylbenzamide
CID 113034958
N-[5-(butylamino)-2-pyridinyl]-3-methylbenzamide
CID 113023966
5-(cyclohexylamino)-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109274899
6-(cyclopropylamino)-N-[3-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 84570944
N-(4-acetamidophenyl)-3-methylbenzamide
CID 730082

Frequently Asked Questions

What is the IUPAC name of N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide?
The IUPAC name of N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide (CID 115268637) is N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide.
What is the SMILES notation for N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide?
The canonical SMILES for N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide is Cc1cccc(C(=O)Nc2ccc(NC3CC3)nc2)c1.
What is the InChIKey of N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide?
The InChIKey is SVXIEVSNWGXZOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-11-3-2-4-12(9-11)16(20)19-14-7-8-15(17-10-14)18-13-5-6-13/h2-4,7-10,13H,5-6H2,1H3,(H,17,18)(H,19,20).
What are the key properties of N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide?
N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide has a molecular weight of 267.33 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(cyclopropylamino)-3-pyridinyl]-3-methylbenzamide is sourced from PubChem (CID 115268637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).