2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide

C14H15N3O — CID 37044565

IUPAC2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
SMILESO=C(CC1CC1)Nc1cccc(-c2ccn[nH]2)c1
InChIInChI=1S/C14H15N3O/c18-14(8-10-4-5-10)16-12-3-1-2-11(9-12)13-6-7-15-17-13/h1-3,6-7,9-10H,4-5,8H2,(H,15,17)(H,16,18)
InChIKeyFSWRGWKVEPAXIU-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.82
Rot. Bonds4

About 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide

2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide (PubChem CID 37044565) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
PubChem CID37044565
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
SMILESO=C(CC1CC1)Nc1cccc(-c2ccn[nH]2)c1
InChIInChI=1S/C14H15N3O/c18-14(8-10-4-5-10)16-12-3-1-2-11(9-12)13-6-7-15-17-13/h1-3,6-7,9-10H,4-5,8H2,(H,15,17)(H,16,18)
InChIKeyFSWRGWKVEPAXIU-UHFFFAOYSA-N
XLogP2.82
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-N'-(3-aminophenyl)-N-[3-(1H-pyrazol-5-yl)phenyl]oct-4-enediamide
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CID 38808772
2-cyclohexyl-N-(3-phenylphenyl)acetamide
CID 53348155
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CID 115452566
1-[[3-(1H-pyrazol-5-yl)phenyl]carbamoyl]piperidine-4-carboxylic acid
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CID 64563413

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide?
The IUPAC name of 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide (CID 37044565) is 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide.
What is the SMILES notation for 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide?
The canonical SMILES for 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide is O=C(CC1CC1)Nc1cccc(-c2ccn[nH]2)c1.
What is the InChIKey of 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide?
The InChIKey is FSWRGWKVEPAXIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c18-14(8-10-4-5-10)16-12-3-1-2-11(9-12)13-6-7-15-17-13/h1-3,6-7,9-10H,4-5,8H2,(H,15,17)(H,16,18).
What are the key properties of 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide?
2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide has a molecular weight of 241.29 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide is sourced from PubChem (CID 37044565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).