N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide

C14H13FN2O3 — CID 110866126

IUPACN-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide
SMILESO=C(NCCc1ccc(F)cc1)NC(=O)c1ccco1
InChIInChI=1S/C14H13FN2O3/c15-11-5-3-10(4-6-11)7-8-16-14(19)17-13(18)12-2-1-9-20-12/h1-6,9H,7-8H2,(H2,16,17,18,19)
InChIKeySFLMEOBEKSFLCC-UHFFFAOYSA-N
MW276.27 g/mol
LogP2.10
Rot. Bonds4

About N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide

N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide (PubChem CID 110866126) has the molecular formula C14H13FN2O3 and a molecular weight of 276.27 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide
PubChem CID110866126
Molecular FormulaC14H13FN2O3
Molecular Weight276.27 g/mol
Exact Mass276.09
IUPAC NameN-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide
SMILESO=C(NCCc1ccc(F)cc1)NC(=O)c1ccco1
InChIInChI=1S/C14H13FN2O3/c15-11-5-3-10(4-6-11)7-8-16-14(19)17-13(18)12-2-1-9-20-12/h1-6,9H,7-8H2,(H2,16,17,18,19)
InChIKeySFLMEOBEKSFLCC-UHFFFAOYSA-N
XLogP2.10
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.27
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-1-[2-(4-fluorophenyl)ethylamino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide
CID 9210434
N-[2-(4-fluorophenyl)ethyl]-4-(furan-2-yl)-4-oxobutanamide
CID 110389848
N-[2-(cyclohexen-1-yl)ethylcarbamoyl]furan-2-carboxamide
CID 110865984
N-[4-(2-phenylethylcarbamoylamino)phenyl]furan-2-carboxamide
CID 38205482
N-(ethylcarbamoyl)furan-2-carboxamide
CID 131178690
N-[3-[2-[2-(4-fluorophenyl)acetyl]hydrazinyl]-3-oxopropyl]furan-2-carboxamide
CID 26656678
1-[2-(4-fluorophenyl)ethyl]-3-prop-1-en-2-ylurea
CID 108910401
N-[2-[4-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]piperazin-1-yl]ethyl]furan-2-carboxamide
CID 34608906
N-[3-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 46407349
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
CID 113028255
N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide
CID 3117526
(E)-N-[2-(4-fluorophenyl)ethyl]-3-(furan-2-yl)prop-2-enamide
CID 7700192

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide (CID 110866126) is N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide is O=C(NCCc1ccc(F)cc1)NC(=O)c1ccco1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide?
The InChIKey is SFLMEOBEKSFLCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O3/c15-11-5-3-10(4-6-11)7-8-16-14(19)17-13(18)12-2-1-9-20-12/h1-6,9H,7-8H2,(H2,16,17,18,19).
What are the key properties of N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide?
N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide has a molecular weight of 276.27 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-carboxamide is sourced from PubChem (CID 110866126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).