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

C16H20N2O3 — CID 110895092

IUPAC1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea
SMILESCC(NC(=O)N(CCO)Cc1ccccc1)c1ccco1
InChIInChI=1S/C16H20N2O3/c1-13(15-8-5-11-21-15)17-16(20)18(9-10-19)12-14-6-3-2-4-7-14/h2-8,11,13,19H,9-10,12H2,1H3,(H,17,20)
InChIKeySXDXEXAATSCJLR-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.54
Rot. Bonds6

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

1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea (PubChem CID 110895092) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea.

Molecular Properties

Compound Name1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea
PubChem CID110895092
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea
SMILESCC(NC(=O)N(CCO)Cc1ccccc1)c1ccco1
InChIInChI=1S/C16H20N2O3/c1-13(15-8-5-11-21-15)17-16(20)18(9-10-19)12-14-6-3-2-4-7-14/h2-8,11,13,19H,9-10,12H2,1H3,(H,17,20)
InChIKeySXDXEXAATSCJLR-UHFFFAOYSA-N
XLogP2.54
TPSA65.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)-1-prop-2-enylurea
CID 111424113
2-[carboxymethyl-[1-(furan-2-yl)ethylcarbamoyl]amino]acetic acid
CID 55246325
1-benzyl-1-(2-hydroxyethyl)-3-pentan-3-ylurea
CID 108888312
1-benzyl-1-(2-hydroxyethyl)-3-[1-(5-methylthiophen-2-yl)propan-2-yl]urea
CID 111439042
1,1-dibenzyl-3-propan-2-ylurea
CID 23988482
N'-benzyl-N,N,N'-tris(2-hydroxyethyl)oxamide
CID 108509868
1-benzyl-1-(2-hydroxyethyl)-3-(4-propan-2-ylphenyl)urea
CID 110896720
(2S)-2-[[furan-2-ylmethyl(2-hydroxyethyl)carbamoyl]amino]-N,N-dimethylpropanamide
CID 125443269
1-benzyl-3-[1-(3,5-dimethyl-1,2-oxazol-4-yl)propan-2-yl]-1-(2-hydroxyethyl)urea
CID 111439082
2-acetamido-N-benzyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 60654045
N-benzyl-N-(2-hydroxyethyl)-2-(propan-2-ylamino)acetamide
CID 54870765
1-benzyl-3-(cyanomethyl)-1-(2-hydroxyethyl)urea
CID 108864764

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea?
The IUPAC name of 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea (CID 110895092) is 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea.
What is the SMILES notation for 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea?
The canonical SMILES for 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea is CC(NC(=O)N(CCO)Cc1ccccc1)c1ccco1.
What is the InChIKey of 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea?
The InChIKey is SXDXEXAATSCJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-13(15-8-5-11-21-15)17-16(20)18(9-10-19)12-14-6-3-2-4-7-14/h2-8,11,13,19H,9-10,12H2,1H3,(H,17,20).
What are the key properties of 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea?
1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea has a molecular weight of 288.35 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-[1-(furan-2-yl)ethyl]-1-(2-hydroxyethyl)urea is sourced from PubChem (CID 110895092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).