N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide

C24H27N3O — CID 155538512

IUPACN-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide
SMILESCc1cc(NC(=O)Cc2cccc(-c3ccccc3)c2)n(C2CCCCC2)n1
InChIInChI=1S/C24H27N3O/c1-18-15-23(27(26-18)22-13-6-3-7-14-22)25-24(28)17-19-9-8-12-21(16-19)20-10-4-2-5-11-20/h2,4-5,8-12,15-16,22H,3,6-7,13-14,17H2,1H3,(H,25,28)
InChIKeyUVHQOMMXNAHCMI-UHFFFAOYSA-N
MW373.50 g/mol
LogP5.54
Rot. Bonds5

About N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide

N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide (PubChem CID 155538512) has the molecular formula C24H27N3O and a molecular weight of 373.50 g/mol. Its IUPAC name is N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide
PubChem CID155538512
Molecular FormulaC24H27N3O
Molecular Weight373.50 g/mol
Exact Mass373.22
IUPAC NameN-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide
SMILESCc1cc(NC(=O)Cc2cccc(-c3ccccc3)c2)n(C2CCCCC2)n1
InChIInChI=1S/C24H27N3O/c1-18-15-23(27(26-18)22-13-6-3-7-14-22)25-24(28)17-19-9-8-12-21(16-19)20-10-4-2-5-11-20/h2,4-5,8-12,15-16,22H,3,6-7,13-14,17H2,1H3,(H,25,28)
InChIKeyUVHQOMMXNAHCMI-UHFFFAOYSA-N
XLogP5.54
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.50
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide?
The IUPAC name of N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide (CID 155538512) is N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide.
What is the SMILES notation for N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide?
The canonical SMILES for N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide is Cc1cc(NC(=O)Cc2cccc(-c3ccccc3)c2)n(C2CCCCC2)n1.
What is the InChIKey of N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide?
The InChIKey is UVHQOMMXNAHCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O/c1-18-15-23(27(26-18)22-13-6-3-7-14-22)25-24(28)17-19-9-8-12-21(16-19)20-10-4-2-5-11-20/h2,4-5,8-12,15-16,22H,3,6-7,13-14,17H2,1H3,(H,25,28).
What are the key properties of N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide?
N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide has a molecular weight of 373.50 g/mol, XLogP of 5.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-5-methylpyrazol-3-yl)-2-(3-phenylphenyl)acetamide is sourced from PubChem (CID 155538512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).