N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide

C19H24N4O2 — CID 72866826

IUPACN-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
SMILESCC(C)c1ccc(N2CC(C(=O)N(C)Cc3ccn[nH]3)CC2=O)cc1
InChIInChI=1S/C19H24N4O2/c1-13(2)14-4-6-17(7-5-14)23-11-15(10-18(23)24)19(25)22(3)12-16-8-9-20-21-16/h4-9,13,15H,10-12H2,1-3H3,(H,20,21)
InChIKeyWHKJVJVWYDUAGP-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.54
Rot. Bonds5

About N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide

N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide (PubChem CID 72866826) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
PubChem CID72866826
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
SMILESCC(C)c1ccc(N2CC(C(=O)N(C)Cc3ccn[nH]3)CC2=O)cc1
InChIInChI=1S/C19H24N4O2/c1-13(2)14-4-6-17(7-5-14)23-11-15(10-18(23)24)19(25)22(3)12-16-8-9-20-21-16/h4-9,13,15H,10-12H2,1-3H3,(H,20,21)
InChIKeyWHKJVJVWYDUAGP-UHFFFAOYSA-N
XLogP2.54
TPSA69.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)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

(3S)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-5-oxo-1-(4-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 97124040
(3R)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-5-oxo-1-(4-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 97123529
N-methyl-5-oxo-N-propan-2-yl-1-(4-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 46705245
N-benzyl-5-oxo-N-propan-2-yl-1-(4-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 113186693
(3S)-5-oxo-1-(4-propan-2-ylphenyl)pyrrolidine-3-carboxylate
CID 6936682
N-benzyl-1-(4-chlorophenyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 17082168
(3S)-N-[(2S)-2-hydroxypropyl]-1-(4-methoxyphenyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 95972030
N-methyl-2-oxo-1-phenyl-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 45214416
1-(4-chlorophenyl)-N-methyl-5-oxo-N-propan-2-ylpyrrolidine-3-carboxamide
CID 87024320
(3S)-5-oxo-1-(4-propan-2-ylphenyl)-N-prop-2-ynylpyrrolidine-3-carboxamide
CID 93018332
(3R)-5-oxo-1-(4-propan-2-ylphenyl)-N-prop-2-ynylpyrrolidine-3-carboxamide
CID 93018331
(3S)-1-cyclohexyl-N-methyl-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 97220946

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide (CID 72866826) is N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide is CC(C)c1ccc(N2CC(C(=O)N(C)Cc3ccn[nH]3)CC2=O)cc1.
What is the InChIKey of N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide?
The InChIKey is WHKJVJVWYDUAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-13(2)14-4-6-17(7-5-14)23-11-15(10-18(23)24)19(25)22(3)12-16-8-9-20-21-16/h4-9,13,15H,10-12H2,1-3H3,(H,20,21).
What are the key properties of N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide?
N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-oxo-1-(4-propan-2-ylphenyl)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 72866826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).