N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide

C15H19N3O2 — CID 19410275

IUPACN-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide
SMILESCCCC(=O)Nc1cnn(Cc2cccc(OC)c2)c1
InChIInChI=1S/C15H19N3O2/c1-3-5-15(19)17-13-9-16-18(11-13)10-12-6-4-7-14(8-12)20-2/h4,6-9,11H,3,5,10H2,1-2H3,(H,17,19)
InChIKeyWJURTCZBGOSOMM-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.68
Rot. Bonds6

About N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide

N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide (PubChem CID 19410275) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide.

Molecular Properties

Compound NameN-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide
PubChem CID19410275
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide
SMILESCCCC(=O)Nc1cnn(Cc2cccc(OC)c2)c1
InChIInChI=1S/C15H19N3O2/c1-3-5-15(19)17-13-9-16-18(11-13)10-12-6-4-7-14(8-12)20-2/h4,6-9,11H,3,5,10H2,1-2H3,(H,17,19)
InChIKeyWJURTCZBGOSOMM-UHFFFAOYSA-N
XLogP2.68
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide 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-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]pentanamide
CID 35521519
2-(4-methoxyphenyl)-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]acetamide
CID 35521443
N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-(4-methylpyrazol-1-yl)propanamide
CID 19559692
3-(4-chloro-3-methylpyrazol-1-yl)-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]propanamide
CID 19544076
1-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-naphthalen-1-ylurea
CID 19447912
4-(1H-indol-3-yl)-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide
CID 19410084
N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-(3-nitropyrazol-1-yl)propanamide
CID 19565937
2-[4-[[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]carbamoyl]pyrazol-1-yl]acetic acid
CID 19500639
1-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-(2-methylphenyl)urea
CID 17284912
2-[[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]carbamoyl]benzoic acid
CID 35521452
2-methoxy-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]benzamide
CID 19410106
N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-3-(5-methyl-3-nitropyrazol-1-yl)propanamide
CID 19541833

Frequently Asked Questions

What is the IUPAC name of N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide?
The IUPAC name of N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide (CID 19410275) is N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide.
What is the SMILES notation for N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide?
The canonical SMILES for N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide is CCCC(=O)Nc1cnn(Cc2cccc(OC)c2)c1.
What is the InChIKey of N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide?
The InChIKey is WJURTCZBGOSOMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-3-5-15(19)17-13-9-16-18(11-13)10-12-6-4-7-14(8-12)20-2/h4,6-9,11H,3,5,10H2,1-2H3,(H,17,19).
What are the key properties of N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide?
N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide has a molecular weight of 273.34 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]butanamide is sourced from PubChem (CID 19410275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).