3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide

C18H19N3O2 — CID 30102772

IUPAC3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide
SMILESO=C(CCc1ccco1)NCCc1ccc(-n2cccn2)cc1
InChIInChI=1S/C18H19N3O2/c22-18(9-8-17-3-1-14-23-17)19-12-10-15-4-6-16(7-5-15)21-13-2-11-20-21/h1-7,11,13-14H,8-10,12H2,(H,19,22)
InChIKeyRHBZFVDNTVTXQR-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.76
Rot. Bonds7

About 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide

3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide (PubChem CID 30102772) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide
PubChem CID30102772
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC Name3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide
SMILESO=C(CCc1ccco1)NCCc1ccc(-n2cccn2)cc1
InChIInChI=1S/C18H19N3O2/c22-18(9-8-17-3-1-14-23-17)19-12-10-15-4-6-16(7-5-15)21-13-2-11-20-21/h1-7,11,13-14H,8-10,12H2,(H,19,22)
InChIKeyRHBZFVDNTVTXQR-UHFFFAOYSA-N
XLogP2.76
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-oxo-1-pyridinyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]acetamide
CID 46604095
N-[2-(1-benzylimidazol-2-yl)ethyl]-3-(furan-2-yl)propanamide
CID 134027637
2-(2-chlorophenyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]acetamide
CID 30525810
3-(2-ethoxyphenyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide
CID 32707909
2-(2-methoxyethylamino)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]acetamide
CID 119699721
3-phenyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]furan-2-carboxamide
CID 43045643
1-[3-(furan-2-ylmethoxy)propyl]-2-methyl-3-[2-(4-pyrazol-1-ylphenyl)ethyl]guanidine;hydroiodide
CID 111399258
3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide
CID 30102749
N-(2-aminoethyl)-3-(furan-2-yl)propanamide
CID 28779702
2-(4-methylphenyl)sulfanyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]acetamide
CID 41412961
4-chloro-N-[4-oxo-4-[2-(4-pyrazol-1-ylphenyl)ethylamino]butyl]benzamide
CID 26081615
3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide
CID 110307624

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide?
The IUPAC name of 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide (CID 30102772) is 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide is O=C(CCc1ccco1)NCCc1ccc(-n2cccn2)cc1.
What is the InChIKey of 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide?
The InChIKey is RHBZFVDNTVTXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c22-18(9-8-17-3-1-14-23-17)19-12-10-15-4-6-16(7-5-15)21-13-2-11-20-21/h1-7,11,13-14H,8-10,12H2,(H,19,22).
What are the key properties of 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide?
3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide has a molecular weight of 309.37 g/mol, XLogP of 2.76, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide is sourced from PubChem (CID 30102772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).