N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide

C17H17N3O — CID 47935018

IUPACN-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide
SMILESCC(C)c1cc(NC(=O)c2ccc3ccccc3c2)n[nH]1
InChIInChI=1S/C17H17N3O/c1-11(2)15-10-16(20-19-15)18-17(21)14-8-7-12-5-3-4-6-13(12)9-14/h3-11H,1-2H3,(H2,18,19,20,21)
InChIKeyUYNADBXRBPQHIR-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.94
Rot. Bonds3

About N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide

N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide (PubChem CID 47935018) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide
PubChem CID47935018
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC NameN-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide
SMILESCC(C)c1cc(NC(=O)c2ccc3ccccc3c2)n[nH]1
InChIInChI=1S/C17H17N3O/c1-11(2)15-10-16(20-19-15)18-17(21)14-8-7-12-5-3-4-6-13(12)9-14/h3-11H,1-2H3,(H2,18,19,20,21)
InChIKeyUYNADBXRBPQHIR-UHFFFAOYSA-N
XLogP3.94
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 47404990
4-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 47404997
4-bromo-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 5330993
3-bromo-4-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 112696168
3-fluoro-4-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 47404897
N-(5-propan-2-yl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indole-6-carboxamide
CID 104618381
4-(carbamoylamino)-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 115592993
2-fluoro-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine-4-carboxamide
CID 103633643
2-chloro-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine-4-carboxamide
CID 47404862
6-(cyclopropylamino)-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine-3-carboxamide
CID 71881616
3-amino-4-ethoxy-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 104616291
6-fluoro-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine-2-carboxamide
CID 113342682

Frequently Asked Questions

What is the IUPAC name of N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide?
The IUPAC name of N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide (CID 47935018) is N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide?
The canonical SMILES for N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide is CC(C)c1cc(NC(=O)c2ccc3ccccc3c2)n[nH]1.
What is the InChIKey of N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide?
The InChIKey is UYNADBXRBPQHIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-11(2)15-10-16(20-19-15)18-17(21)14-8-7-12-5-3-4-6-13(12)9-14/h3-11H,1-2H3,(H2,18,19,20,21).
What are the key properties of N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide?
N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 3.94, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-propan-2-yl-1H-pyrazol-3-yl)naphthalene-2-carboxamide is sourced from PubChem (CID 47935018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).