N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide

C15H13N3O2 — CID 71935022

IUPACN-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide
SMILESCC(=O)Nc1cc(-c2ccoc2)nn1-c1ccccc1
InChIInChI=1S/C15H13N3O2/c1-11(19)16-15-9-14(12-7-8-20-10-12)17-18(15)13-5-3-2-4-6-13/h2-10H,1H3,(H,16,19)
InChIKeyNNWZWCBGNFAQRR-UHFFFAOYSA-N
MW267.29 g/mol
LogP3.09
Rot. Bonds3

About N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide

N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide (PubChem CID 71935022) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide.

Molecular Properties

Compound NameN-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide
PubChem CID71935022
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC NameN-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide
SMILESCC(=O)Nc1cc(-c2ccoc2)nn1-c1ccccc1
InChIInChI=1S/C15H13N3O2/c1-11(19)16-15-9-14(12-7-8-20-10-12)17-18(15)13-5-3-2-4-6-13/h2-10H,1H3,(H,16,19)
InChIKeyNNWZWCBGNFAQRR-UHFFFAOYSA-N
XLogP3.09
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide?
The IUPAC name of N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide (CID 71935022) is N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide.
What is the SMILES notation for N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide?
The canonical SMILES for N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide is CC(=O)Nc1cc(-c2ccoc2)nn1-c1ccccc1.
What is the InChIKey of N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide?
The InChIKey is NNWZWCBGNFAQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-11(19)16-15-9-14(12-7-8-20-10-12)17-18(15)13-5-3-2-4-6-13/h2-10H,1H3,(H,16,19).
What are the key properties of N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide?
N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide has a molecular weight of 267.29 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-3-yl)-1-phenylpyrazol-5-yl]acetamide is sourced from PubChem (CID 71935022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).