N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide

C15H20N4O — CID 62177273

IUPACN-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NCc1cn[nH]c1C
InChIInChI=1S/C15H20N4O/c1-3-8-16-14-7-5-4-6-13(14)15(20)17-9-12-10-18-19-11(12)2/h4-7,10,16H,3,8-9H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyVZDZDEFVVTZEPJ-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.47
Rot. Bonds6

About N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide (PubChem CID 62177273) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide
PubChem CID62177273
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NCc1cn[nH]c1C
InChIInChI=1S/C15H20N4O/c1-3-8-16-14-7-5-4-6-13(14)15(20)17-9-12-10-18-19-11(12)2/h4-7,10,16H,3,8-9H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyVZDZDEFVVTZEPJ-UHFFFAOYSA-N
XLogP2.47
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide 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-[(2-methylphenyl)methyl]-2-(propylamino)benzamide
CID 62179332
2-[2-(methylamino)ethyl]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide
CID 104547624
N-[(5-methylpyrazin-2-yl)methyl]-2-(propylamino)benzamide
CID 62841224
3-(ethylamino)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 105069649
2,5-dimethyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide
CID 60736020
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)pyridine-4-carboxamide
CID 62178161
3,6-dimethyl-2-[(5-methyl-1H-pyrazol-4-yl)methylcarbamoyl]benzoic acid
CID 103428946
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-prop-2-enoxybenzamide
CID 61003173
3-hydrazinyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-nitrobenzamide
CID 115549530
N-(3-hydroxypropyl)-2-(propylamino)benzamide
CID 55178627
3-[[2-(propylamino)benzoyl]amino]propanoic acid
CID 63107977
N-(1,2,4-oxadiazol-3-ylmethyl)-2-(propylamino)benzamide
CID 106402474

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide?
The IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide (CID 62177273) is N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide.
What is the SMILES notation for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide?
The canonical SMILES for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)NCc1cn[nH]c1C.
What is the InChIKey of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide?
The InChIKey is VZDZDEFVVTZEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-3-8-16-14-7-5-4-6-13(14)15(20)17-9-12-10-18-19-11(12)2/h4-7,10,16H,3,8-9H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide?
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide has a molecular weight of 272.35 g/mol, XLogP of 2.47, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)benzamide is sourced from PubChem (CID 62177273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).