N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide

C15H13NO3 — CID 6066314

IUPACN-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)/C=C/c2ccco2)cc1
InChIInChI=1S/C15H13NO3/c1-11(17)16-13-6-4-12(5-7-13)15(18)9-8-14-3-2-10-19-14/h2-10H,1H3,(H,16,17)/b9-8+
InChIKeyZMOHIPHNIXDSOW-CMDGGOBGSA-N
MW255.27 g/mol
LogP3.13
Rot. Bonds4

About N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide

N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide (PubChem CID 6066314) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide
PubChem CID6066314
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC NameN-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)/C=C/c2ccco2)cc1
InChIInChI=1S/C15H13NO3/c1-11(17)16-13-6-4-12(5-7-13)15(18)9-8-14-3-2-10-19-14/h2-10H,1H3,(H,16,17)/b9-8+
InChIKeyZMOHIPHNIXDSOW-CMDGGOBGSA-N
XLogP3.13
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

Fenfuram
CID 90590
2,5-Dimethyl-3-furancarboxanilide
CID 34281
N-(4-methylphenyl)furan-2-carboxamide
CID 785196
Benzamide, N-(4-ethoxyphenyl)-
CID 203878
4-amino-N-(2-methoxyphenyl)benzamide
CID 2317363
(2E)-2-cyano-3-(5-methylfuran-2-yl)-N-(3-methylphenyl)prop-2-enamide
CID 738805
4-(furan-2-yl)-2-methyl-5-oxo-N-(o-tolyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
CID 11646235
(5E)-5-[(E)-3-(furan-2-yl)prop-2-enylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione
CID 1911770
(2Z)-3-(2-furyl)-N-(2-methoxyphenyl)acrylamide
CID 2303040
4-(2-furyl)-2,6-dimethyl-N3,N5-diphenyl-1,4-dihydropyridine-3,5-dicarboxamide
CID 21716122
N-(2-methylphenyl)-2-furamide
CID 2246088
4-(3-Furanyl)benzenamine
CID 44420988

Frequently Asked Questions

What is the IUPAC name of N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide (CID 6066314) is N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide is CC(=O)Nc1ccc(C(=O)/C=C/c2ccco2)cc1.
What is the InChIKey of N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide?
The InChIKey is ZMOHIPHNIXDSOW-CMDGGOBGSA-N. The full InChI is InChI=1S/C15H13NO3/c1-11(17)16-13-6-4-12(5-7-13)15(18)9-8-14-3-2-10-19-14/h2-10H,1H3,(H,16,17)/b9-8+.
What are the key properties of N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide?
N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide has a molecular weight of 255.27 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(E)-3-(furan-2-yl)prop-2-enoyl]phenyl]acetamide is sourced from PubChem (CID 6066314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).