N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide

C12H17F3N4O — CID 63710738

IUPACN-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
SMILESCC(C)n1nccc1NC(=O)C1(C(F)(F)F)CCNC1
InChIInChI=1S/C12H17F3N4O/c1-8(2)19-9(3-5-17-19)18-10(20)11(12(13,14)15)4-6-16-7-11/h3,5,8,16H,4,6-7H2,1-2H3,(H,18,20)
InChIKeyUQSBBEUCGSCNIB-UHFFFAOYSA-N
MW290.29 g/mol
LogP1.94
Rot. Bonds3

About N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide

N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide (PubChem CID 63710738) has the molecular formula C12H17F3N4O and a molecular weight of 290.29 g/mol. Its IUPAC name is N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
PubChem CID63710738
Molecular FormulaC12H17F3N4O
Molecular Weight290.29 g/mol
Exact Mass290.14
IUPAC NameN-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
SMILESCC(C)n1nccc1NC(=O)C1(C(F)(F)F)CCNC1
InChIInChI=1S/C12H17F3N4O/c1-8(2)19-9(3-5-17-19)18-10(20)11(12(13,14)15)4-6-16-7-11/h3,5,8,16H,4,6-7H2,1-2H3,(H,18,20)
InChIKeyUQSBBEUCGSCNIB-UHFFFAOYSA-N
XLogP1.94
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)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

3-[(1-Methylpyrazol-3-yl)amino]-1-propan-2-ylpyrrolidin-2-one
CID 71981220
N-[1-(pyrrolidin-3-yl)-1H-pyrazol-3-yl]acetamide dihydrochloride
CID 86767537
N-(2-propan-2-ylpyrazol-3-yl)-2-pyrrolidin-1-ylacetamide
CID 33177226
3-methyl-N-{1-[1-(3,3,3-trifluoro-1-methylpropyl)-4-piperidinyl]-1H-pyrazol-5-yl}butanamide
CID 45930241
1-Pyrrolidin-1-yl-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]propan-1-one
CID 86795461
N,N-dimethyl-3-[[2-[(2S)-4-methylpentan-2-yl]pyrazol-3-yl]carbamoylamino]propanamide
CID 97307869
1-[(2S)-2-[[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]amino]propanoyl]imidazolidin-2-one
CID 97835953
(5S)-3-(2-propan-2-ylpyrazol-3-yl)-5-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione
CID 124293901
3-cyano-N-[2-[2-(dimethylamino)ethyl]pyrazol-3-yl]-3-methylbutanamide
CID 132378241
(1R)-N-(2-ethylpyrazol-3-yl)-2,2-difluoro-1-methylcyclopropane-1-carboxamide
CID 164632144
(3S)-N-(4-methyl-1-propylpyrazol-5-yl)-3-pyrazol-1-ylbutanamide
CID 164632323
N-(1-Ethyl-1H-pyrazol-5-yl)-2,2,2-trifluoroacetamide
CID 57698727

Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide (CID 63710738) is N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide is CC(C)n1nccc1NC(=O)C1(C(F)(F)F)CCNC1.
What is the InChIKey of N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide?
The InChIKey is UQSBBEUCGSCNIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17F3N4O/c1-8(2)19-9(3-5-17-19)18-10(20)11(12(13,14)15)4-6-16-7-11/h3,5,8,16H,4,6-7H2,1-2H3,(H,18,20).
What are the key properties of N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide?
N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide has a molecular weight of 290.29 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylpyrazol-3-yl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 63710738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).