1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea

C15H17N3O2 — CID 108871519

IUPAC1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea
SMILESCN(C)c1cccc(NC(=O)Nc2ccccc2O)c1
InChIInChI=1S/C15H17N3O2/c1-18(2)12-7-5-6-11(10-12)16-15(20)17-13-8-3-4-9-14(13)19/h3-10,19H,1-2H3,(H2,16,17,20)
InChIKeyHZOYYSQLBRVKJL-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.10
Rot. Bonds3

About 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea

1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea (PubChem CID 108871519) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea.

Molecular Properties

Compound Name1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea
PubChem CID108871519
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea
SMILESCN(C)c1cccc(NC(=O)Nc2ccccc2O)c1
InChIInChI=1S/C15H17N3O2/c1-18(2)12-7-5-6-11(10-12)16-15(20)17-13-8-3-4-9-14(13)19/h3-10,19H,1-2H3,(H2,16,17,20)
InChIKeyHZOYYSQLBRVKJL-UHFFFAOYSA-N
XLogP3.10
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

1-[4-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea
CID 71414128
N-[3-[[3-(dimethylamino)phenyl]carbamoylamino]phenyl]acetamide
CID 108884172
[3-(dimethylamino)phenyl]carbamic acid
CID 91129511
1-[3-(dimethylamino)phenyl]-3-(4-methoxyphenyl)urea
CID 108866355
N-[3-(dimethylamino)phenyl]-N'-(2-fluorophenyl)oxamide
CID 108520830
[3-[(2-hydroxyphenyl)carbamoylamino]phenyl] acetate
CID 108865153
1-[3-(dimethylamino)phenyl]-3-[(E)-prop-1-enyl]urea
CID 108909610
1-[3-(dimethylamino)phenyl]-3-(1,2-oxazol-3-yl)urea
CID 108811956
1-[3-(dimethylamino)phenyl]-3-(2,3-dimethylquinoxalin-6-yl)urea
CID 108885626
1-(2-chloro-6-fluorophenyl)-3-[3-(dimethylamino)phenyl]urea
CID 108896576
1-(2-methylphenyl)-3-[3-[(2-methylphenyl)carbamoylamino]phenyl]urea
CID 1110848
1-[2-(dimethylamino)phenyl]-3-phenylurea
CID 110472237

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea?
The IUPAC name of 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea (CID 108871519) is 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea.
What is the SMILES notation for 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea?
The canonical SMILES for 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea is CN(C)c1cccc(NC(=O)Nc2ccccc2O)c1.
What is the InChIKey of 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea?
The InChIKey is HZOYYSQLBRVKJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-18(2)12-7-5-6-11(10-12)16-15(20)17-13-8-3-4-9-14(13)19/h3-10,19H,1-2H3,(H2,16,17,20).
What are the key properties of 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea?
1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea has a molecular weight of 271.32 g/mol, XLogP of 3.10, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dimethylamino)phenyl]-3-(2-hydroxyphenyl)urea is sourced from PubChem (CID 108871519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).