(4-methoxyphenyl) N-(3-aminophenyl)carbamate

C14H14N2O3 — CID 12941472

IUPAC(4-methoxyphenyl) N-(3-aminophenyl)carbamate
SMILESCOc1ccc(OC(=O)Nc2cccc(N)c2)cc1
InChIInChI=1S/C14H14N2O3/c1-18-12-5-7-13(8-6-12)19-14(17)16-11-4-2-3-10(15)9-11/h2-9H,15H2,1H3,(H,16,17)
InChIKeyFPYALOGHVWXGQZ-UHFFFAOYSA-N
MW258.28 g/mol
LogP2.89
Rot. Bonds3

About (4-methoxyphenyl) N-(3-aminophenyl)carbamate

(4-methoxyphenyl) N-(3-aminophenyl)carbamate (PubChem CID 12941472) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is (4-methoxyphenyl) N-(3-aminophenyl)carbamate.

Molecular Properties

Compound Name(4-methoxyphenyl) N-(3-aminophenyl)carbamate
PubChem CID12941472
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name(4-methoxyphenyl) N-(3-aminophenyl)carbamate
SMILESCOc1ccc(OC(=O)Nc2cccc(N)c2)cc1
InChIInChI=1S/C14H14N2O3/c1-18-12-5-7-13(8-6-12)19-14(17)16-11-4-2-3-10(15)9-11/h2-9H,15H2,1H3,(H,16,17)
InChIKeyFPYALOGHVWXGQZ-UHFFFAOYSA-N
XLogP2.89
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 52.89
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

3-N-(4-methoxyphenyl)benzene-1,3-diamine
CID 22486418
(3,5-dimethoxyphenyl) N-phenylcarbamate
CID 23281948
(4-methoxyphenyl) N-[4-amino-2-(2-aminophenyl)phenyl]carbamate
CID 68788093
N-(3-aminophenyl)-2-methoxyacetamide
CID 11137720
N-(3-aminophenyl)acetamide;hydrate;hydrochloride
CID 91872080
N-(3-aminophenyl)-2-(2-bromo-4-methoxyphenoxy)acetamide
CID 104706751
methyl N-[3-[(3-aminobenzoyl)amino]phenyl]carbamate
CID 60927753
phenyl N-(3-pyridin-2-yloxyphenyl)carbamate;3-pyridin-2-yloxyaniline
CID 167710607
[3-(phenoxycarbonylamino)phenyl] N-methylcarbamate
CID 134105214
butan-2-yl N-(3-aminophenyl)carbamate
CID 60904542
2-(3-aminophenyl)-N-(4-methoxyphenyl)propanamide
CID 106590702
1-(3-methoxyphenyl)-3-(4-methoxyphenyl)urea
CID 872322

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl) N-(3-aminophenyl)carbamate?
The IUPAC name of (4-methoxyphenyl) N-(3-aminophenyl)carbamate (CID 12941472) is (4-methoxyphenyl) N-(3-aminophenyl)carbamate.
What is the SMILES notation for (4-methoxyphenyl) N-(3-aminophenyl)carbamate?
The canonical SMILES for (4-methoxyphenyl) N-(3-aminophenyl)carbamate is COc1ccc(OC(=O)Nc2cccc(N)c2)cc1.
What is the InChIKey of (4-methoxyphenyl) N-(3-aminophenyl)carbamate?
The InChIKey is FPYALOGHVWXGQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-18-12-5-7-13(8-6-12)19-14(17)16-11-4-2-3-10(15)9-11/h2-9H,15H2,1H3,(H,16,17).
What are the key properties of (4-methoxyphenyl) N-(3-aminophenyl)carbamate?
(4-methoxyphenyl) N-(3-aminophenyl)carbamate has a molecular weight of 258.28 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl) N-(3-aminophenyl)carbamate is sourced from PubChem (CID 12941472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).