1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea

C19H24N2O3 — CID 111426647

IUPAC1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea
SMILESCOCC(O)CNC(=O)NCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24N2O3/c1-24-14-17(22)12-20-19(23)21-13-18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,17-18,22H,12-14H2,1H3,(H2,20,21,23)
InChIKeyCIXWGJSBEKPFRY-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.12
Rot. Bonds8

About 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea

1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea (PubChem CID 111426647) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea.

Molecular Properties

Compound Name1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea
PubChem CID111426647
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea
SMILESCOCC(O)CNC(=O)NCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24N2O3/c1-24-14-17(22)12-20-19(23)21-13-18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,17-18,22H,12-14H2,1H3,(H2,20,21,23)
InChIKeyCIXWGJSBEKPFRY-UHFFFAOYSA-N
XLogP2.12
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,2-diphenylethyl)-3-ethylurea
CID 47133841
1-(2-hydroxypentyl)-3-(2-methoxy-1-phenylethyl)urea
CID 111338426
1-methoxy-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 78953875
methyl 2-(2,2-diphenylethylcarbamoylamino)propanoate
CID 3493714
1-[(3-chlorophenyl)methyl]-3-(2-hydroxy-3-methoxypropyl)urea
CID 111426617
1-(2-hydroxy-3-methoxypropyl)-3-[1-(4-methylphenyl)ethyl]urea
CID 111426760
(2S)-2-(2,2-diphenylethylcarbamoylamino)propanoic acid
CID 2005904
1-[(2R)-1-(2-bromophenyl)propan-2-yl]-3-[(2R)-2-hydroxy-3-methoxypropyl]urea
CID 97087832
1-[(2,4-dichlorophenyl)methyl]-3-(2-hydroxy-3-methoxypropyl)urea
CID 111426624
1-benzyl-3-(3-hydroxy-4-methoxybutyl)urea
CID 103875504
1-(2,3-dihydro-1H-inden-1-yl)-3-(2-hydroxy-3-methoxypropyl)urea
CID 111426668
(2S)-2-hydroxy-3-(2-phenylpropylcarbamoylamino)propanoic acid
CID 107840975

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea?
The IUPAC name of 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea (CID 111426647) is 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea.
What is the SMILES notation for 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea?
The canonical SMILES for 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea is COCC(O)CNC(=O)NCC(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea?
The InChIKey is CIXWGJSBEKPFRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-24-14-17(22)12-20-19(23)21-13-18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,17-18,22H,12-14H2,1H3,(H2,20,21,23).
What are the key properties of 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea?
1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea has a molecular weight of 328.41 g/mol, XLogP of 2.12, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-diphenylethyl)-3-(2-hydroxy-3-methoxypropyl)urea is sourced from PubChem (CID 111426647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).