5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide

C15H16N4O2 — CID 168698340

IUPAC5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ccc(Cn3cccn3)cc2)C1
InChIInChI=1S/C15H16N4O2/c16-15(21)12-8-14(20)19(10-12)13-4-2-11(3-5-13)9-18-7-1-6-17-18/h1-7,12H,8-10H2,(H2,16,21)
InChIKeyDPRAPTNFZPRLDM-UHFFFAOYSA-N
MW284.32 g/mol
LogP0.77
Rot. Bonds4

About 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide

5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide (PubChem CID 168698340) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide
PubChem CID168698340
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ccc(Cn3cccn3)cc2)C1
InChIInChI=1S/C15H16N4O2/c16-15(21)12-8-14(20)19(10-12)13-4-2-11(3-5-13)9-18-7-1-6-17-18/h1-7,12H,8-10H2,(H2,16,21)
InChIKeyDPRAPTNFZPRLDM-UHFFFAOYSA-N
XLogP0.77
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide 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

4-(aminomethyl)-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidin-2-one
CID 168661197
1-[4-[(4-aminophenyl)methyl]phenyl]-5-oxopyrrolidine-3-carboxamide
CID 168698337
1-(4-ethylphenyl)-5-oxo-N-[[3-(pyrazol-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide
CID 60552206
1-(4-aminophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168697847
3-[4-(4-carbamoyl-2-oxopyrrolidin-1-yl)phenyl]propanoic acid
CID 168698330
1-(4-methylsulfanylphenyl)-5-oxo-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide
CID 42944485
(3S)-1-[3-[(4R)-4-carbamoyl-2-oxopyrrolidin-1-yl]phenyl]-5-oxopyrrolidine-3-carboxamide
CID 94076238
1-(4-ethynylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 168695945
5-oxo-1-(4-phenyldiazenylphenyl)pyrrolidine-3-carboxamide
CID 168697851
5-oxo-1-[4-(piperidin-1-ylmethyl)phenyl]pyrrolidine-3-carboxylic acid
CID 122445928
(3S)-1-(4-butoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 2174533
(3R)-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carboxamide
CID 99969292

Frequently Asked Questions

What is the IUPAC name of 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide?
The IUPAC name of 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide (CID 168698340) is 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide?
The canonical SMILES for 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide is NC(=O)C1CC(=O)N(c2ccc(Cn3cccn3)cc2)C1.
What is the InChIKey of 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide?
The InChIKey is DPRAPTNFZPRLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c16-15(21)12-8-14(20)19(10-12)13-4-2-11(3-5-13)9-18-7-1-6-17-18/h1-7,12H,8-10H2,(H2,16,21).
What are the key properties of 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide?
5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 0.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-1-[4-(pyrazol-1-ylmethyl)phenyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 168698340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).