1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea

C19H24N2O2 — CID 110896766

IUPAC1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea
SMILESCCCc1ccccc1NC(=O)N(CCO)Cc1ccccc1
InChIInChI=1S/C19H24N2O2/c1-2-8-17-11-6-7-12-18(17)20-19(23)21(13-14-22)15-16-9-4-3-5-10-16/h3-7,9-12,22H,2,8,13-15H2,1H3,(H,20,23)
InChIKeyYRBBWTOAJGGVBF-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.67
Rot. Bonds7

About 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea

1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea (PubChem CID 110896766) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea.

Molecular Properties

Compound Name1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea
PubChem CID110896766
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea
SMILESCCCc1ccccc1NC(=O)N(CCO)Cc1ccccc1
InChIInChI=1S/C19H24N2O2/c1-2-8-17-11-6-7-12-18(17)20-19(23)21(13-14-22)15-16-9-4-3-5-10-16/h3-7,9-12,22H,2,8,13-15H2,1H3,(H,20,23)
InChIKeyYRBBWTOAJGGVBF-UHFFFAOYSA-N
XLogP3.67
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-diethyl-3-(2-propylphenyl)urea
CID 113233204
2-[2-[[2-hydroxyethyl(propyl)carbamoyl]amino]phenyl]acetic acid
CID 62535180
1-benzyl-3-[2-[ethyl(methyl)amino]phenyl]-1-(2-hydroxyethyl)urea
CID 111117127
1-benzyl-3-(2-chloro-3-methylphenyl)-1-(2-hydroxyethyl)urea
CID 111521290
2-[2-[[benzyl-[2-(dimethylamino)ethyl]carbamoyl]amino]phenyl]-N,N-dimethylacetamide
CID 60577554
1-benzyl-3-phenyl-1-propylurea
CID 78786424
1-benzyl-1-(2-hydroxyethyl)-3-pentan-3-ylurea
CID 108888312
1-benzyl-1-(2-hydroxyethyl)-3-(1H-indol-3-yl)urea
CID 7615873
N'-benzyl-N-ethyl-N'-(2-hydroxyethyl)oxamide
CID 108521418
N'-benzyl-N,N,N'-tris(2-hydroxyethyl)oxamide
CID 108509868
1-benzyl-1-(2-hydroxyethyl)-3-(4-propan-2-ylphenyl)urea
CID 110896720
2-[2-[[2-hydroxyethyl-[(2-methoxyphenyl)methyl]carbamoyl]amino]phenyl]-N-methylacetamide
CID 55819269

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea?
The IUPAC name of 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea (CID 110896766) is 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea.
What is the SMILES notation for 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea?
The canonical SMILES for 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea is CCCc1ccccc1NC(=O)N(CCO)Cc1ccccc1.
What is the InChIKey of 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea?
The InChIKey is YRBBWTOAJGGVBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-2-8-17-11-6-7-12-18(17)20-19(23)21(13-14-22)15-16-9-4-3-5-10-16/h3-7,9-12,22H,2,8,13-15H2,1H3,(H,20,23).
What are the key properties of 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea?
1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea has a molecular weight of 312.41 g/mol, XLogP of 3.67, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-1-(2-hydroxyethyl)-3-(2-propylphenyl)urea is sourced from PubChem (CID 110896766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).