(4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate

C20H18N2O3 — CID 68785591

IUPAC(4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate
SMILESCOc1ccc(OC(=O)Nc2cc(-c3ccccc3)ccc2N)cc1
InChIInChI=1S/C20H18N2O3/c1-24-16-8-10-17(11-9-16)25-20(23)22-19-13-15(7-12-18(19)21)14-5-3-2-4-6-14/h2-13H,21H2,1H3,(H,22,23)
InChIKeyXRCORAHUHKKLOS-UHFFFAOYSA-N
MW334.38 g/mol
LogP4.56
Rot. Bonds4

About (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate

(4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate (PubChem CID 68785591) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate.

Molecular Properties

Compound Name(4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate
PubChem CID68785591
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC Name(4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate
SMILESCOc1ccc(OC(=O)Nc2cc(-c3ccccc3)ccc2N)cc1
InChIInChI=1S/C20H18N2O3/c1-24-16-8-10-17(11-9-16)25-20(23)22-19-13-15(7-12-18(19)21)14-5-3-2-4-6-14/h2-13H,21H2,1H3,(H,22,23)
InChIKeyXRCORAHUHKKLOS-UHFFFAOYSA-N
XLogP4.56
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-5-phenylphenyl)-4-methoxybenzamide;N-methylmethanamine
CID 66894745
N-[2-amino-5-(4-hydroxyphenyl)phenyl]-4-methoxybenzamide
CID 59736664
N-[2-amino-5-(3-hydroxyphenyl)phenyl]-4-methoxybenzamide
CID 59736690
(4-methoxyphenyl) N-[4-amino-2-(2-aminophenyl)phenyl]carbamate
CID 68788093
5-methoxy-2-(phenoxycarbonylamino)benzoic acid
CID 115411200
methyl N-[[4-[(2-amino-5-phenylphenyl)carbamoyl]phenyl]methyl]carbamate
CID 25032862
(4-methoxyphenyl) N-(3-aminophenyl)carbamate
CID 12941472
methyl 2-amino-4-phenylbenzoate
CID 53412316
N'-(2-amino-5-methylphenyl)-N-(4-methoxyphenyl)oxamide
CID 108502699
N-(2-amino-5-methoxyphenyl)-4-methyl-3-phenylpentanamide
CID 119420670
N-(2-amino-5-phenylphenyl)-4-propan-2-ylbenzamide
CID 126707746
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate?
The IUPAC name of (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate (CID 68785591) is (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate.
What is the SMILES notation for (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate?
The canonical SMILES for (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate is COc1ccc(OC(=O)Nc2cc(-c3ccccc3)ccc2N)cc1.
What is the InChIKey of (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate?
The InChIKey is XRCORAHUHKKLOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-24-16-8-10-17(11-9-16)25-20(23)22-19-13-15(7-12-18(19)21)14-5-3-2-4-6-14/h2-13H,21H2,1H3,(H,22,23).
What are the key properties of (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate?
(4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate has a molecular weight of 334.38 g/mol, XLogP of 4.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl) N-(2-amino-5-phenylphenyl)carbamate is sourced from PubChem (CID 68785591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).