1-benzyl-3-[2-(furan-2-yl)ethenyl]urea

C14H14N2O2 — CID 4262431

IUPAC1-benzyl-3-[2-(furan-2-yl)ethenyl]urea
SMILESO=C(NC=Cc1ccco1)NCc1ccccc1
InChIInChI=1S/C14H14N2O2/c17-14(15-9-8-13-7-4-10-18-13)16-11-12-5-2-1-3-6-12/h1-10H,11H2,(H2,15,16,17)
InChIKeyNZZQKSWQEZCYLD-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.75
Rot. Bonds4

About 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea

1-benzyl-3-[2-(furan-2-yl)ethenyl]urea (PubChem CID 4262431) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea.

Molecular Properties

Compound Name1-benzyl-3-[2-(furan-2-yl)ethenyl]urea
PubChem CID4262431
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name1-benzyl-3-[2-(furan-2-yl)ethenyl]urea
SMILESO=C(NC=Cc1ccco1)NCc1ccccc1
InChIInChI=1S/C14H14N2O2/c17-14(15-9-8-13-7-4-10-18-13)16-11-12-5-2-1-3-6-12/h1-10H,11H2,(H2,15,16,17)
InChIKeyNZZQKSWQEZCYLD-UHFFFAOYSA-N
XLogP2.75
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-3-[(E)-2-(2-bromophenyl)ethenyl]urea
CID 108905000
(E)-3-(furan-2-yl)-N-[(4-phenoxyphenyl)methyl]prop-2-enamide
CID 60619034
(E)-N,N-dibenzyl-3-(furan-2-yl)prop-2-enamide
CID 790450
(E)-3-(furan-2-yl)-N-(2-phenylethyl)prop-2-enamide
CID 790283
(E)-N-[(4-chlorophenyl)methyl]-3-(furan-2-yl)prop-2-enamide
CID 779270
3-(furan-2-yl)-N-[(4-methylphenyl)methyl]prop-2-enamide
CID 963854
(Z)-N-benzyl-3-(furan-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enamide
CID 2293574
(E)-3-(furan-2-yl)-N-(hydroxymethyl)prop-2-enamide
CID 131239465
4-[[[(E)-2-(2-fluorophenyl)ethenyl]carbamoylamino]methyl]benzoic acid
CID 108904347
N-benzyl-N-[2-[benzyl-[3-(furan-2-yl)prop-2-enoyl]amino]ethyl]-3-(furan-2-yl)prop-2-enamide
CID 2920998
1-benzyl-3-[(Z)-furan-2-ylmethylideneamino]thiourea
CID 5415725
1-[(4-methoxyphenyl)methyl]-3-[(E)-2-phenylethenyl]urea
CID 108903141

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea?
The IUPAC name of 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea (CID 4262431) is 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea.
What is the SMILES notation for 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea?
The canonical SMILES for 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea is O=C(NC=Cc1ccco1)NCc1ccccc1.
What is the InChIKey of 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea?
The InChIKey is NZZQKSWQEZCYLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c17-14(15-9-8-13-7-4-10-18-13)16-11-12-5-2-1-3-6-12/h1-10H,11H2,(H2,15,16,17).
What are the key properties of 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea?
1-benzyl-3-[2-(furan-2-yl)ethenyl]urea has a molecular weight of 242.28 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-[2-(furan-2-yl)ethenyl]urea is sourced from PubChem (CID 4262431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).