2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide

C11H10ClN3O — CID 60615735

IUPAC2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide
SMILESO=C(Cc1cccc(Cl)c1)Nc1ccn[nH]1
InChIInChI=1S/C11H10ClN3O/c12-9-3-1-2-8(6-9)7-11(16)14-10-4-5-13-15-10/h1-6H,7H2,(H2,13,14,15,16)
InChIKeyLCNSJTBDOQKWIP-UHFFFAOYSA-N
MW235.67 g/mol
LogP2.24
Rot. Bonds3

About 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide

2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide (PubChem CID 60615735) has the molecular formula C11H10ClN3O and a molecular weight of 235.67 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide
PubChem CID60615735
Molecular FormulaC11H10ClN3O
Molecular Weight235.67 g/mol
Exact Mass235.05
IUPAC Name2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide
SMILESO=C(Cc1cccc(Cl)c1)Nc1ccn[nH]1
InChIInChI=1S/C11H10ClN3O/c12-9-3-1-2-8(6-9)7-11(16)14-10-4-5-13-15-10/h1-6H,7H2,(H2,13,14,15,16)
InChIKeyLCNSJTBDOQKWIP-UHFFFAOYSA-N
XLogP2.24
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.67
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromo-4-fluorophenyl)-N-(1H-pyrazol-5-yl)acetamide
CID 47466464
2-(3-chlorophenyl)-N-(5-methyl-1H-pyrazol-4-yl)acetamide
CID 154858274
2-(3-chlorophenyl)-N-pyrazin-2-ylacetamide
CID 127120451
2-(3-methoxy-4-methylphenyl)-N-(1H-pyrazol-5-yl)acetamide
CID 61393750
2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide
CID 110723735
N-[3-(chloromethyl)phenyl]-2-(3-chlorophenyl)acetamide
CID 113270904
N-(3-bromo-5-chloro-2-hydroxyphenyl)-2-(3-chlorophenyl)acetamide
CID 22618247
N-(3-chlorophenyl)-2-(3-methylphenyl)acetamide
CID 9497443
2-(3-bromophenyl)-N-(4-chloro-2-pyridinyl)acetamide
CID 115627297
4-[[2-(3-chlorophenyl)acetyl]amino]benzamide
CID 56922735
2-(3-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide
CID 103097835
N-(2-bromo-5-fluorophenyl)-2-(3-chlorophenyl)acetamide
CID 103753346

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide (CID 60615735) is 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide is O=C(Cc1cccc(Cl)c1)Nc1ccn[nH]1.
What is the InChIKey of 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide?
The InChIKey is LCNSJTBDOQKWIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3O/c12-9-3-1-2-8(6-9)7-11(16)14-10-4-5-13-15-10/h1-6H,7H2,(H2,13,14,15,16).
What are the key properties of 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide?
2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide has a molecular weight of 235.67 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-(1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 60615735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).