2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide

C17H28N4O2 — CID 84596088

IUPAC2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide
SMILESCCC(NC(=O)N1CCCC1c1c(C)n[nH]c1C)C1CCCO1
InChIInChI=1S/C17H28N4O2/c1-4-13(15-8-6-10-23-15)18-17(22)21-9-5-7-14(21)16-11(2)19-20-12(16)3/h13-15H,4-10H2,1-3H3,(H,18,22)(H,19,20)
InChIKeyLIACGMAMMXXMHF-UHFFFAOYSA-N
MW320.44 g/mol
LogP2.83
Rot. Bonds4

About 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide (PubChem CID 84596088) has the molecular formula C17H28N4O2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide
PubChem CID84596088
Molecular FormulaC17H28N4O2
Molecular Weight320.44 g/mol
Exact Mass320.22
IUPAC Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide
SMILESCCC(NC(=O)N1CCCC1c1c(C)n[nH]c1C)C1CCCO1
InChIInChI=1S/C17H28N4O2/c1-4-13(15-8-6-10-23-15)18-17(22)21-9-5-7-14(21)16-11(2)19-20-12(16)3/h13-15H,4-10H2,1-3H3,(H,18,22)(H,19,20)
InChIKeyLIACGMAMMXXMHF-UHFFFAOYSA-N
XLogP2.83
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-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

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(1-thiophen-2-ylpropyl)pyrrolidine-1-carboxamide
CID 75515790
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[2-(oxolan-2-yl)ethyl]azepane-1-carboxamide
CID 75475872
(2S)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2R)-4-methoxy-4-methylpentan-2-yl]pyrrolidine-1-carboxamide
CID 97333211
(2S)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(1R)-1-[(3R)-oxolan-3-yl]ethyl]azepane-1-carboxamide
CID 124885821
(2S)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(2-methoxyethyl)pyrrolidine-1-carboxamide
CID 97158372
(2S)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[2-(2-methylpropanoylamino)ethyl]azepane-1-carboxamide
CID 98574717
(2R)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2S)-2-methoxy-3,3-dimethylbutyl]pyrrolidine-1-carboxamide
CID 97333226
(2S)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2S)-2-[(3R)-3-methylmorpholin-4-yl]propyl]pyrrolidine-1-carboxamide
CID 129446030
(2S)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2S)-2-thiophen-2-ylpropyl]pyrrolidine-1-carboxamide
CID 97333197
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2-methyloxolan-2-yl)methyl]azepane-1-carboxamide
CID 75501149
tert-butyl (2R)-2-(3,5-dimethyl-1H-pyrazol-4-yl)pyrrolidine-1-carboxylate
CID 99978628
(2R)-2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(3,3,3-trifluoropropyl)azepane-1-carboxamide
CID 99853243

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide?
The IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide (CID 84596088) is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide?
The canonical SMILES for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide is CCC(NC(=O)N1CCCC1c1c(C)n[nH]c1C)C1CCCO1.
What is the InChIKey of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide?
The InChIKey is LIACGMAMMXXMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O2/c1-4-13(15-8-6-10-23-15)18-17(22)21-9-5-7-14(21)16-11(2)19-20-12(16)3/h13-15H,4-10H2,1-3H3,(H,18,22)(H,19,20).
What are the key properties of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide?
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide has a molecular weight of 320.44 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[1-(oxolan-2-yl)propyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 84596088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).