5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide

C19H19N3O — CID 46577659

IUPAC5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide
SMILESCC(NC(=O)c1cc(C2CC2)[nH]n1)c1cccc2ccccc12
InChIInChI=1S/C19H19N3O/c1-12(15-8-4-6-13-5-2-3-7-16(13)15)20-19(23)18-11-17(21-22-18)14-9-10-14/h2-8,11-12,14H,9-10H2,1H3,(H,20,23)(H,21,22)
InChIKeyBFOMHDJYDQFOKE-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.93
Rot. Bonds4

About 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide

5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide (PubChem CID 46577659) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide
PubChem CID46577659
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide
SMILESCC(NC(=O)c1cc(C2CC2)[nH]n1)c1cccc2ccccc12
InChIInChI=1S/C19H19N3O/c1-12(15-8-4-6-13-5-2-3-7-16(13)15)20-19(23)18-11-17(21-22-18)14-9-10-14/h2-8,11-12,14H,9-10H2,1H3,(H,20,23)(H,21,22)
InChIKeyBFOMHDJYDQFOKE-UHFFFAOYSA-N
XLogP3.93
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-naphthalen-1-ylethyl)-2H-triazole-4-carboxamide
CID 112732639
5-cyclopropyl-N-(1-pyridin-2-ylethyl)-1H-pyrazole-3-carboxamide
CID 43057191
5-cyclopropyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide
CID 47161141
5-cyclopropyl-N-(1-hydroxypropan-2-yl)-1H-pyrazole-3-carboxamide
CID 146085389
5-cyclopropyl-N-(1-cyclopropylethyl)-1H-pyrazole-3-carboxamide
CID 47158112
5-cyclopropyl-N-[(1R)-1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 126448270
5-cyclopropyl-N-(2-phenylpropyl)-1H-pyrazole-3-carboxamide
CID 20918125
N-(1-naphthalen-1-ylethyl)naphthalene-1-carboxamide
CID 593320
5-cyclopropyl-N-[(1R)-1-[2-[2-(methylamino)-2-oxoethoxy]phenyl]propyl]-1H-pyrazole-3-carboxamide
CID 52511609
methyl 2-[(5-cyclopropyl-1H-pyrazole-3-carbonyl)amino]-4-methylpentanoate
CID 47158124
N'-(1-naphthalen-1-ylethyl)-N-[(1S)-1-naphthalen-1-ylethyl]oxamide
CID 90809930
N-[(1R)-1-naphthalen-1-ylethyl]-6-oxo-2-phenyl-1H-pyrimidine-4-carboxamide
CID 136982863

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide (CID 46577659) is 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide is CC(NC(=O)c1cc(C2CC2)[nH]n1)c1cccc2ccccc12.
What is the InChIKey of 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide?
The InChIKey is BFOMHDJYDQFOKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-12(15-8-4-6-13-5-2-3-7-16(13)15)20-19(23)18-11-17(21-22-18)14-9-10-14/h2-8,11-12,14H,9-10H2,1H3,(H,20,23)(H,21,22).
What are the key properties of 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide?
5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 3.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(1-naphthalen-1-ylethyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 46577659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).