N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide

C16H21N3O — CID 166191819

IUPACN-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide
SMILESCCCN(CC)C(=O)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C16H21N3O/c1-3-11-18(4-2)16(20)15-8-6-14(7-9-15)13-19-12-5-10-17-19/h5-10,12H,3-4,11,13H2,1-2H3
InChIKeyQTZZXXUXNDEWMQ-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.80
Rot. Bonds6

About N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide

N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide (PubChem CID 166191819) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide
PubChem CID166191819
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide
SMILESCCCN(CC)C(=O)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C16H21N3O/c1-3-11-18(4-2)16(20)15-8-6-14(7-9-15)13-19-12-5-10-17-19/h5-10,12H,3-4,11,13H2,1-2H3
InChIKeyQTZZXXUXNDEWMQ-UHFFFAOYSA-N
XLogP2.80
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)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-ethyl-4-[(4-methylpiperazin-1-yl)methyl]-N-(2-pyrazol-1-ylethyl)benzamide
CID 91782708
N-[(3-chlorophenyl)methyl]-N-ethyl-4-(pyrazol-1-ylmethyl)benzamide
CID 55594648
N-[(3-ethoxy-4-propoxyphenyl)methyl]-N-propyl-4-(pyrazol-1-ylmethyl)benzamide
CID 55502855
N-[4-(diethylcarbamoyl)phenyl]-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide
CID 24630760
N-ethyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 135667533
N-[(3R,4S,5R)-4,5-dihydroxyoxan-3-yl]-N-propyl-4-(pyrazol-1-ylmethyl)benzamide
CID 155996402
4-[ethyl(propyl)carbamoyl]benzoic acid
CID 43452972
N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 38807472
N-(2-methylpropyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 18136496
2-[cyclopropyl-[4-(pyrazol-1-ylmethyl)benzoyl]amino]acetic acid
CID 119194650
N-[4-(diethylamino)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 134036419
1-[(4-ethylphenyl)methyl]pyrazole
CID 63811734

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide?
The IUPAC name of N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide (CID 166191819) is N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide.
What is the SMILES notation for N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide?
The canonical SMILES for N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide is CCCN(CC)C(=O)c1ccc(Cn2cccn2)cc1.
What is the InChIKey of N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide?
The InChIKey is QTZZXXUXNDEWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-3-11-18(4-2)16(20)15-8-6-14(7-9-15)13-19-12-5-10-17-19/h5-10,12H,3-4,11,13H2,1-2H3.
What are the key properties of N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide?
N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide has a molecular weight of 271.36 g/mol, XLogP of 2.80, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propyl-4-(pyrazol-1-ylmethyl)benzamide is sourced from PubChem (CID 166191819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).