1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea

C17H20N2O3 — CID 111424849

IUPAC1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea
SMILESCc1cc(OCc2ccccc2)ccc1NC(=O)NCCO
InChIInChI=1S/C17H20N2O3/c1-13-11-15(22-12-14-5-3-2-4-6-14)7-8-16(13)19-17(21)18-9-10-20/h2-8,11,20H,9-10,12H2,1H3,(H2,18,19,21)
InChIKeyIMPYNFSJVOLORA-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.69
Rot. Bonds6

About 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea

1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea (PubChem CID 111424849) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea
PubChem CID111424849
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea
SMILESCc1cc(OCc2ccccc2)ccc1NC(=O)NCCO
InChIInChI=1S/C17H20N2O3/c1-13-11-15(22-12-14-5-3-2-4-6-14)7-8-16(13)19-17(21)18-9-10-20/h2-8,11,20H,9-10,12H2,1H3,(H2,18,19,21)
InChIKeyIMPYNFSJVOLORA-UHFFFAOYSA-N
XLogP2.69
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-hydroxyethyl)-3-(2-methyl-4-propoxyphenyl)urea
CID 47326596
N-(2-methyl-4-phenylmethoxyphenyl)-2-pyrrolidin-1-ylacetamide
CID 3046011
1-(3-hydroxypropyl)-3-(4-methoxy-2-methylphenyl)urea
CID 110933093
1-(2-hydroxyethyl)-3-[2-methyl-3-(phenoxymethyl)phenyl]urea
CID 71865833
1-[[1-(2-methoxyethyl)-3,5-dimethylpyrazol-4-yl]methyl]-3-(2-methyl-4-phenylmethoxyphenyl)urea
CID 86967280
2-chloro-N-[2-methyl-4-[(4-methylphenyl)methoxy]phenyl]acetamide
CID 39431489
N-(2-hydroxyethyl)-4-phenylmethoxybenzamide
CID 10825986
1-(2,4-difluorophenyl)-3-[2-(4-phenylmethoxyphenyl)ethyl]urea
CID 141080201
N-(2-methyl-4-propoxyphenyl)-3-[(2-phenylacetyl)amino]propanamide
CID 55904755
N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide
CID 171338561
methyl 2-methyl-4-phenylmethoxybenzoate
CID 21194710
1-(4-iodo-2-methylphenyl)-3-(2-phenylethyl)urea
CID 47186088

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea?
The IUPAC name of 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea (CID 111424849) is 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea.
What is the SMILES notation for 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea?
The canonical SMILES for 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea is Cc1cc(OCc2ccccc2)ccc1NC(=O)NCCO.
What is the InChIKey of 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea?
The InChIKey is IMPYNFSJVOLORA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-13-11-15(22-12-14-5-3-2-4-6-14)7-8-16(13)19-17(21)18-9-10-20/h2-8,11,20H,9-10,12H2,1H3,(H2,18,19,21).
What are the key properties of 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea?
1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea has a molecular weight of 300.36 g/mol, XLogP of 2.69, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-3-(2-methyl-4-phenylmethoxyphenyl)urea is sourced from PubChem (CID 111424849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).