N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide

C17H20N4O — CID 51100168

IUPACN-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide
SMILESO=C(NC1CCN(C2CC2)C1)c1ccn(-c2ccccc2)n1
InChIInChI=1S/C17H20N4O/c22-17(18-13-8-10-20(12-13)14-6-7-14)16-9-11-21(19-16)15-4-2-1-3-5-15/h1-5,9,11,13-14H,6-8,10,12H2,(H,18,22)
InChIKeyVPDQEYKFUICZDX-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.84
Rot. Bonds4

About N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide

N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide (PubChem CID 51100168) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide
PubChem CID51100168
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide
SMILESO=C(NC1CCN(C2CC2)C1)c1ccn(-c2ccccc2)n1
InChIInChI=1S/C17H20N4O/c22-17(18-13-8-10-20(12-13)14-6-7-14)16-9-11-21(19-16)15-4-2-1-3-5-15/h1-5,9,11,13-14H,6-8,10,12H2,(H,18,22)
InChIKeyVPDQEYKFUICZDX-UHFFFAOYSA-N
XLogP1.84
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-cyanopyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide
CID 134363588
N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-1-phenylpyrazole-3-carboxamide
CID 51078940
1-phenyl-N-piperidin-3-ylpyrazole-3-carboxamide;hydrochloride
CID 119429116
6-chloro-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 62233324
N-[2-(cycloheptylamino)ethyl]-1-phenylpyrazole-3-carboxamide
CID 119621404
N-[(3S)-1-cyclopropylpyrrolidin-3-yl]-1-(4-fluorophenyl)triazole-4-carboxamide
CID 95293281
5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 81317228
1-(1-cyclopropylpyrrolidin-3-yl)-3-phenylurea
CID 47816038
N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide
CID 47937761
N-cyclooctyl-1-(4-fluorophenyl)pyrazole-3-carboxamide
CID 38701604
1-(4-fluorophenyl)-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrazole-3-carboxamide
CID 95137538
2-methyl-N-[(3S)-1-(1-phenylpyrazole-3-carbonyl)piperidin-3-yl]propanamide
CID 94800796

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide?
The IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide (CID 51100168) is N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide?
The canonical SMILES for N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide is O=C(NC1CCN(C2CC2)C1)c1ccn(-c2ccccc2)n1.
What is the InChIKey of N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide?
The InChIKey is VPDQEYKFUICZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c22-17(18-13-8-10-20(12-13)14-6-7-14)16-9-11-21(19-16)15-4-2-1-3-5-15/h1-5,9,11,13-14H,6-8,10,12H2,(H,18,22).
What are the key properties of N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide?
N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 51100168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).