N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide

C16H15N3O — CID 47038585

IUPACN-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide
SMILESCc1cc(NC(=O)Cc2ccc3ccccc3c2)n[nH]1
InChIInChI=1S/C16H15N3O/c1-11-8-15(19-18-11)17-16(20)10-12-6-7-13-4-2-3-5-14(13)9-12/h2-9H,10H2,1H3,(H2,17,18,19,20)
InChIKeyZECIJVLCESDXAQ-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.05
Rot. Bonds3

About N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide

N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide (PubChem CID 47038585) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide
PubChem CID47038585
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC NameN-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide
SMILESCc1cc(NC(=O)Cc2ccc3ccccc3c2)n[nH]1
InChIInChI=1S/C16H15N3O/c1-11-8-15(19-18-11)17-16(20)10-12-6-7-13-4-2-3-5-14(13)9-12/h2-9H,10H2,1H3,(H2,17,18,19,20)
InChIKeyZECIJVLCESDXAQ-UHFFFAOYSA-N
XLogP3.05
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide?
The IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide (CID 47038585) is N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide is Cc1cc(NC(=O)Cc2ccc3ccccc3c2)n[nH]1.
What is the InChIKey of N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide?
The InChIKey is ZECIJVLCESDXAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11-8-15(19-18-11)17-16(20)10-12-6-7-13-4-2-3-5-14(13)9-12/h2-9H,10H2,1H3,(H2,17,18,19,20).
What are the key properties of N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide?
N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide has a molecular weight of 265.32 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-pyrazol-3-yl)-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 47038585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).