(2-amino-4-methoxyphenyl)carbamic acid

C8H10N2O3 — CID 22317519

IUPAC(2-amino-4-methoxyphenyl)carbamic acid
SMILESCOc1ccc(NC(=O)O)c(N)c1
InChIInChI=1S/C8H10N2O3/c1-13-5-2-3-7(6(9)4-5)10-8(11)12/h2-4,10H,9H2,1H3,(H,11,12)
InChIKeyJFVUANRAJPHYOJ-UHFFFAOYSA-N
MW182.18 g/mol
LogP1.37
Rot. Bonds2

About (2-amino-4-methoxyphenyl)carbamic acid

(2-amino-4-methoxyphenyl)carbamic acid (PubChem CID 22317519) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is (2-amino-4-methoxyphenyl)carbamic acid.

Molecular Properties

Compound Name(2-amino-4-methoxyphenyl)carbamic acid
PubChem CID22317519
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name(2-amino-4-methoxyphenyl)carbamic acid
SMILESCOc1ccc(NC(=O)O)c(N)c1
InChIInChI=1S/C8H10N2O3/c1-13-5-2-3-7(6(9)4-5)10-8(11)12/h2-4,10H,9H2,1H3,(H,11,12)
InChIKeyJFVUANRAJPHYOJ-UHFFFAOYSA-N
XLogP1.37
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-N-(2-amino-4-methoxyphenyl)-2-methylbutanamide
CID 40788880
N-(2-amino-4-methoxyphenyl)-2-[2-(2-methoxyethoxy)ethoxy]acetamide
CID 104560142
1-(2-amino-4-methoxyphenyl)-3-propylurea
CID 28785607
N-(2-amino-4-methoxyphenyl)cyclobutanecarboxamide
CID 16774141
N-(2-amino-4-methoxyphenyl)pyridine-4-carboxamide
CID 16776915
N-(2-amino-4-methoxyphenyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 65199378
N-(2-amino-4-methoxyphenyl)pyrimidine-5-carboxamide
CID 102921224
2-hydrazinyl-5-methoxyaniline
CID 119013430
3-amino-4-[(4-methoxybenzoyl)amino]benzoic acid
CID 63117294
N-(2-amino-4-methoxyphenyl)-3,4-dichlorobenzamide
CID 16777237
N-(2-amino-4-methoxyphenyl)nonanamide
CID 65449480
N-(2-amino-4-methoxyphenyl)naphthalene-2-carboxamide
CID 16775616

Frequently Asked Questions

What is the IUPAC name of (2-amino-4-methoxyphenyl)carbamic acid?
The IUPAC name of (2-amino-4-methoxyphenyl)carbamic acid (CID 22317519) is (2-amino-4-methoxyphenyl)carbamic acid.
What is the SMILES notation for (2-amino-4-methoxyphenyl)carbamic acid?
The canonical SMILES for (2-amino-4-methoxyphenyl)carbamic acid is COc1ccc(NC(=O)O)c(N)c1.
What is the InChIKey of (2-amino-4-methoxyphenyl)carbamic acid?
The InChIKey is JFVUANRAJPHYOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c1-13-5-2-3-7(6(9)4-5)10-8(11)12/h2-4,10H,9H2,1H3,(H,11,12).
What are the key properties of (2-amino-4-methoxyphenyl)carbamic acid?
(2-amino-4-methoxyphenyl)carbamic acid has a molecular weight of 182.18 g/mol, XLogP of 1.37, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-methoxyphenyl)carbamic acid is sourced from PubChem (CID 22317519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).