amino-(4-methoxyphenyl)carbamic acid

C8H10N2O3 — CID 66864834

IUPACamino-(4-methoxyphenyl)carbamic acid
SMILESCOc1ccc(N(N)C(=O)O)cc1
InChIInChI=1S/C8H10N2O3/c1-13-7-4-2-6(3-5-7)10(9)8(11)12/h2-5H,9H2,1H3,(H,11,12)
InChIKeyUFJDLTORIAQDHU-UHFFFAOYSA-N
MW182.18 g/mol
LogP1.05
Rot. Bonds2

About amino-(4-methoxyphenyl)carbamic acid

amino-(4-methoxyphenyl)carbamic acid (PubChem CID 66864834) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is amino-(4-methoxyphenyl)carbamic acid.

Molecular Properties

Compound Nameamino-(4-methoxyphenyl)carbamic acid
PubChem CID66864834
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Nameamino-(4-methoxyphenyl)carbamic acid
SMILESCOc1ccc(N(N)C(=O)O)cc1
InChIInChI=1S/C8H10N2O3/c1-13-7-4-2-6(3-5-7)10(9)8(11)12/h2-5H,9H2,1H3,(H,11,12)
InChIKeyUFJDLTORIAQDHU-UHFFFAOYSA-N
XLogP1.05
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(4-methoxyphenyl)-methylcarbamic acid
CID 22047987
(2S,3R,4R)-2,3,4,5-tetrahydroxy-N-(4-methoxyphenyl)pentanehydrazide
CID 121010077
1,1-bis(4-methoxyphenyl)hydrazine;hydrochloride
CID 20517959
N-(4-methoxyphenyl)pyridine-2-carbohydrazide
CID 91595717
2-(4-chlorophenoxy)-N-(4-methoxyphenyl)acetohydrazide
CID 163509592
(4-methoxyphenoxy)carbamic acid
CID 152670091
2-[N-(carboxymethyl)-4-methoxyanilino]acetic acid
CID 4712243
N,N-bis(4-methoxyphenyl)-2-oxopropanamide;ethane
CID 143471525
methyl 2-(N-amino-4-methoxyanilino)acetate
CID 54130144
carbamic acid;2-[N-(2-hydroxyethyl)-4-methoxyanilino]ethanol
CID 71435780
(4-methoxy-N-(4-methoxyphenyl)anilino) acetate
CID 175095203
1-N,1-N,4-N,4-N-tetrakis(4-methoxyphenyl)benzene-1,4-diamine
CID 18996647

Frequently Asked Questions

What is the IUPAC name of amino-(4-methoxyphenyl)carbamic acid?
The IUPAC name of amino-(4-methoxyphenyl)carbamic acid (CID 66864834) is amino-(4-methoxyphenyl)carbamic acid.
What is the SMILES notation for amino-(4-methoxyphenyl)carbamic acid?
The canonical SMILES for amino-(4-methoxyphenyl)carbamic acid is COc1ccc(N(N)C(=O)O)cc1.
What is the InChIKey of amino-(4-methoxyphenyl)carbamic acid?
The InChIKey is UFJDLTORIAQDHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c1-13-7-4-2-6(3-5-7)10(9)8(11)12/h2-5H,9H2,1H3,(H,11,12).
What are the key properties of amino-(4-methoxyphenyl)carbamic acid?
amino-(4-methoxyphenyl)carbamic acid has a molecular weight of 182.18 g/mol, XLogP of 1.05, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for amino-(4-methoxyphenyl)carbamic acid is sourced from PubChem (CID 66864834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).