[4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate

C15H13NO4 — CID 117058910

IUPAC[4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate
SMILESCNC(=O)Oc1ccc(C(=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C15H13NO4/c1-16-15(19)20-13-8-4-11(5-9-13)14(18)10-2-6-12(17)7-3-10/h2-9,17H,1H3,(H,16,19)
InChIKeyFRPIGQRLRIHYKE-UHFFFAOYSA-N
MW271.27 g/mol
LogP2.34
Rot. Bonds3

About [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate

[4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate (PubChem CID 117058910) has the molecular formula C15H13NO4 and a molecular weight of 271.27 g/mol. Its IUPAC name is [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate.

Molecular Properties

Compound Name[4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate
PubChem CID117058910
Molecular FormulaC15H13NO4
Molecular Weight271.27 g/mol
Exact Mass271.08
IUPAC Name[4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate
SMILESCNC(=O)Oc1ccc(C(=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C15H13NO4/c1-16-15(19)20-13-8-4-11(5-9-13)14(18)10-2-6-12(17)7-3-10/h2-9,17H,1H3,(H,16,19)
InChIKeyFRPIGQRLRIHYKE-UHFFFAOYSA-N
XLogP2.34
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate 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

[4-[4-(4-hydroxybenzoyl)oxybenzoyl]phenyl] 4-hydroxybenzoate
CID 121312948
[4-(4-hydroxybenzoyl)phenyl] hypoiodite
CID 142136796
(4-hydroxyphenyl) N-tert-butylcarbamate
CID 19747177
(4-hydroxyphenyl)-[4-[4-[4-[4-(4-methoxybenzoyl)benzoyl]phenoxy]benzoyl]phenyl]methanone
CID 140957067
(4-hydroxyphenyl)-phenylmethanone;phenyl hydrogen carbonate
CID 118078754
[4-(difluoromethoxy)phenyl] N-methylcarbamate
CID 165349276
(4-hydroxyphenyl) 4-carboxyoxybenzoate
CID 126668327
[4-(carbamoylamino)phenyl] N-methylcarbamate
CID 134123032
[4-(dimethylamino)phenyl] N-methylcarbamate;iodomethane
CID 23618192
[4-[4-[2-(methylamino)ethoxy]benzoyl]phenyl] N-[2-[4-(4-hydroxybenzoyl)phenoxy]ethyl]-N-methylcarbamate
CID 176680104
benzene-1,4-diol;bis(4-chlorophenyl)methanone;[4-[4-[4-(4-chlorobenzoyl)phenoxy]phenoxy]phenyl]-(4-chlorophenyl)methanone
CID 159184900
(4-methoxyphenyl) 4-hydroxybenzoate
CID 578384

Frequently Asked Questions

What is the IUPAC name of [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate?
The IUPAC name of [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate (CID 117058910) is [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate.
What is the SMILES notation for [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate?
The canonical SMILES for [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate is CNC(=O)Oc1ccc(C(=O)c2ccc(O)cc2)cc1.
What is the InChIKey of [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate?
The InChIKey is FRPIGQRLRIHYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO4/c1-16-15(19)20-13-8-4-11(5-9-13)14(18)10-2-6-12(17)7-3-10/h2-9,17H,1H3,(H,16,19).
What are the key properties of [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate?
[4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate has a molecular weight of 271.27 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate is sourced from PubChem (CID 117058910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).