(4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium

C14H15N2O2+ — CID 163695975

IUPAC(4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium
SMILESCc1ccc([NH2+]C(=O)Nc2ccc(O)cc2)cc1
InChIInChI=1S/C14H14N2O2/c1-10-2-4-11(5-3-10)15-14(18)16-12-6-8-13(17)9-7-12/h2-9,17H,1H3,(H2,15,16,18)/p+1
InChIKeyJWZJACXHAKZOII-UHFFFAOYSA-O
MW243.29 g/mol
LogP2.13
Rot. Bonds2

About (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium

(4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium (PubChem CID 163695975) has the molecular formula C14H15N2O2+ and a molecular weight of 243.29 g/mol. Its IUPAC name is (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium.

Molecular Properties

Compound Name(4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium
PubChem CID163695975
Molecular FormulaC14H15N2O2+
Molecular Weight243.29 g/mol
Exact Mass243.11
IUPAC Name(4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium
SMILESCc1ccc([NH2+]C(=O)Nc2ccc(O)cc2)cc1
InChIInChI=1S/C14H14N2O2/c1-10-2-4-11(5-3-10)15-14(18)16-12-6-8-13(17)9-7-12/h2-9,17H,1H3,(H2,15,16,18)/p+1
InChIKeyJWZJACXHAKZOII-UHFFFAOYSA-O
XLogP2.13
TPSA65.94 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium 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-(4-methylphenyl)-3-[(4-methylphenyl)carbamoylamino]urea
CID 54178073
N-(4-methylphenyl)acetamide
CID 7684
(E)-3-[(4-hydroxyphenyl)diazenyl]-N-(4-methylphenyl)prop-2-enamide
CID 135471534
4-methylphenol
CID 70549076
(2E,4E)-5-(4-hydroxyphenyl)-N-(4-methylphenyl)penta-2,4-dienamide
CID 10492944
N-(4-hydroxyphenyl)acetamide;dihydrate
CID 140999210
N-(4-hydroxyphenyl)acetamide;iron
CID 69304461
2-[4-[2-(4-hydroxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methylphenyl)acetamide
CID 71095079
N-[(4-hydroxyphenyl)carbamothioyl]-4-methylbenzamide
CID 909226
1-(4-hydroxyphenyl)-3-(4-methylphenyl)sulfonylurea
CID 5268819
methanamine;N-(4-methylphenyl)acetamide
CID 142152295
(E)-N,N'-bis(4-hydroxyphenyl)but-2-enediamide
CID 5356642

Frequently Asked Questions

What is the IUPAC name of (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium?
The IUPAC name of (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium (CID 163695975) is (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium.
What is the SMILES notation for (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium?
The canonical SMILES for (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium is Cc1ccc([NH2+]C(=O)Nc2ccc(O)cc2)cc1.
What is the InChIKey of (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium?
The InChIKey is JWZJACXHAKZOII-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H14N2O2/c1-10-2-4-11(5-3-10)15-14(18)16-12-6-8-13(17)9-7-12/h2-9,17H,1H3,(H2,15,16,18)/p+1.
What are the key properties of (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium?
(4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium has a molecular weight of 243.29 g/mol, XLogP of 2.13, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxyphenyl)carbamoyl-(4-methylphenyl)azanium is sourced from PubChem (CID 163695975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).