1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea

C19H23N3O3 — CID 122150685

IUPAC1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea
SMILESCc1cc(O)ccc1NC(=O)Nc1ccccc1CN1CCOCC1
InChIInChI=1S/C19H23N3O3/c1-14-12-16(23)6-7-17(14)20-19(24)21-18-5-3-2-4-15(18)13-22-8-10-25-11-9-22/h2-7,12,23H,8-11,13H2,1H3,(H2,20,21,24)
InChIKeyINRRGWWHKFUYCW-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.18
Rot. Bonds4

About 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea

1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea (PubChem CID 122150685) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea.

Molecular Properties

Compound Name1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea
PubChem CID122150685
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea
SMILESCc1cc(O)ccc1NC(=O)Nc1ccccc1CN1CCOCC1
InChIInChI=1S/C19H23N3O3/c1-14-12-16(23)6-7-17(14)20-19(24)21-18-5-3-2-4-15(18)13-22-8-10-25-11-9-22/h2-7,12,23H,8-11,13H2,1H3,(H2,20,21,24)
InChIKeyINRRGWWHKFUYCW-UHFFFAOYSA-N
XLogP3.18
TPSA73.83 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[2-(morpholin-4-ylmethyl)phenyl]propanamide;dihydrochloride
CID 119859628
1-ethyl-4,6-dimethyl-N-[2-(morpholin-4-ylmethyl)phenyl]-2-oxopyridine-3-carboxamide
CID 131905733
2,6-dimethyl-N-[2-(morpholin-4-ylmethyl)phenyl]pyrimidine-4-carboxamide
CID 131930694
2-methyl-5-methylsulfonyl-N-[2-(morpholin-4-ylmethyl)phenyl]benzamide
CID 55899314
3,5-dichloro-N-[2-(morpholin-4-ylmethyl)phenyl]benzamide
CID 55898935
1-(2-methylphenyl)-3-[[3-(morpholin-4-ylmethyl)phenyl]methyl]urea
CID 87008869
4-(2-methylphenoxy)-N-[2-(morpholin-4-ylmethyl)phenyl]butanamide
CID 55900210
1-(2,4-dimethylphenyl)-3-(2-morpholin-4-ylphenyl)urea
CID 108991302
N-(4-hydroxy-2-methylphenyl)-2-morpholin-4-yl-2-oxoacetamide
CID 108509448
1-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-3-[2-(morpholin-4-ylmethyl)phenyl]urea
CID 124594022
4-methyl-N-[2-(morpholin-4-ylmethyl)phenyl]-3-pyrazol-1-ylbenzamide
CID 46968974
4-[[2-(morpholin-4-ylmethyl)phenyl]carbamoyl]thiophene-2-carboxylic acid
CID 166295875

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea?
The IUPAC name of 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea (CID 122150685) is 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea.
What is the SMILES notation for 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea?
The canonical SMILES for 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea is Cc1cc(O)ccc1NC(=O)Nc1ccccc1CN1CCOCC1.
What is the InChIKey of 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea?
The InChIKey is INRRGWWHKFUYCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-14-12-16(23)6-7-17(14)20-19(24)21-18-5-3-2-4-15(18)13-22-8-10-25-11-9-22/h2-7,12,23H,8-11,13H2,1H3,(H2,20,21,24).
What are the key properties of 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea?
1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea has a molecular weight of 341.41 g/mol, XLogP of 3.18, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxy-2-methylphenyl)-3-[2-(morpholin-4-ylmethyl)phenyl]urea is sourced from PubChem (CID 122150685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).