N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide

C12H14N4O — CID 115319572

IUPACN-[2-(4-aminopyrazol-1-yl)ethyl]benzamide
SMILESNc1cnn(CCNC(=O)c2ccccc2)c1
InChIInChI=1S/C12H14N4O/c13-11-8-15-16(9-11)7-6-14-12(17)10-4-2-1-3-5-10/h1-5,8-9H,6-7,13H2,(H,14,17)
InChIKeyMHIOCDNLOVHXDO-UHFFFAOYSA-N
MW230.27 g/mol
LogP0.90
Rot. Bonds4

About N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide

N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide (PubChem CID 115319572) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide.

Molecular Properties

Compound NameN-[2-(4-aminopyrazol-1-yl)ethyl]benzamide
PubChem CID115319572
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-[2-(4-aminopyrazol-1-yl)ethyl]benzamide
SMILESNc1cnn(CCNC(=O)c2ccccc2)c1
InChIInChI=1S/C12H14N4O/c13-11-8-15-16(9-11)7-6-14-12(17)10-4-2-1-3-5-10/h1-5,8-9H,6-7,13H2,(H,14,17)
InChIKeyMHIOCDNLOVHXDO-UHFFFAOYSA-N
XLogP0.90
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(4-aminopyrazol-1-yl)ethyl]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-(4-aminopyrazol-1-yl)ethyl]-3-hydroxybenzamide
CID 115319665
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-hydroxybenzamide
CID 115319755
N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylsulfanylbenzamide
CID 115319726
N-[2-(4-aminopyrazol-1-yl)ethyl]-2,6-difluorobenzamide
CID 115319778
N-[2-(4-aminopyrazol-1-yl)ethyl]-3-(dimethylamino)benzamide
CID 115319557
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-(2,6-difluorophenyl)acetamide
CID 115319698
N-[2-(4-aminopyrazol-1-yl)ethyl]-5-bromopyridine-3-carboxamide
CID 113285893
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-(difluoromethoxy)benzamide
CID 115319564
N-[2-(4-aminopyrazol-1-yl)ethyl]-5-bromothiophene-2-carboxamide
CID 113285899
N-[2-(4-aminopyrazol-1-yl)ethyl]-5-chloro-2-methylbenzamide
CID 82881102
N-[2-(4-aminopyrazol-1-yl)ethyl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 115319761
N-[2-(4-aminopyrazol-1-yl)ethyl]-1-methylimidazole-4-carboxamide
CID 107971078

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide?
The IUPAC name of N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide (CID 115319572) is N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide.
What is the SMILES notation for N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide?
The canonical SMILES for N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide is Nc1cnn(CCNC(=O)c2ccccc2)c1.
What is the InChIKey of N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide?
The InChIKey is MHIOCDNLOVHXDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c13-11-8-15-16(9-11)7-6-14-12(17)10-4-2-1-3-5-10/h1-5,8-9H,6-7,13H2,(H,14,17).
What are the key properties of N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide?
N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide has a molecular weight of 230.27 g/mol, XLogP of 0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminopyrazol-1-yl)ethyl]benzamide is sourced from PubChem (CID 115319572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).