(2-hydroxy-3-methoxyphenyl) carbamate

C8H9NO4 — CID 68617707

IUPAC(2-hydroxy-3-methoxyphenyl) carbamate
SMILESCOc1cccc(OC(N)=O)c1O
InChIInChI=1S/C8H9NO4/c1-12-5-3-2-4-6(7(5)10)13-8(9)11/h2-4,10H,1H3,(H2,9,11)
InChIKeyGWCBDSXJOWYBKZ-UHFFFAOYSA-N
MW183.16 g/mol
LogP0.86
Rot. Bonds2

About (2-hydroxy-3-methoxyphenyl) carbamate

(2-hydroxy-3-methoxyphenyl) carbamate (PubChem CID 68617707) has the molecular formula C8H9NO4 and a molecular weight of 183.16 g/mol. Its IUPAC name is (2-hydroxy-3-methoxyphenyl) carbamate.

Molecular Properties

Compound Name(2-hydroxy-3-methoxyphenyl) carbamate
PubChem CID68617707
Molecular FormulaC8H9NO4
Molecular Weight183.16 g/mol
Exact Mass183.05
IUPAC Name(2-hydroxy-3-methoxyphenyl) carbamate
SMILESCOc1cccc(OC(N)=O)c1O
InChIInChI=1S/C8H9NO4/c1-12-5-3-2-4-6(7(5)10)13-8(9)11/h2-4,10H,1H3,(H2,9,11)
InChIKeyGWCBDSXJOWYBKZ-UHFFFAOYSA-N
XLogP0.86
TPSA81.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.16
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-Dimethoxy-phenol boronic acid
CID 68597712
(E)-(2-hydroxy-3-methoxyphenyl)methylideneurea
CID 137275710
2-[(2-hydroxy-3-methoxybenzoyl)amino]ethyl carbamate
CID 83203383
3-amino-3-(2-hydroxy-3-methoxyphenyl)propanamide
CID 170875664
(2,3-difluorophenyl) carbamate
CID 154511519
(2-hydroxy-3-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 67681144
(2-formyl-3-hydroxyphenyl) carbamate
CID 175040502
(4-chloro-2-methoxyphenyl) carbamate
CID 130017787
(3-methoxy-4-pyridinyl) carbamate
CID 90285344
2-(3-methoxy-2-methylphenyl)acetamide
CID 141044512
2-hydroxy-3-methoxybenzaldehyde
CID 8991
(2-methoxyphenyl) 2-methylpropanoate
CID 836904

Frequently Asked Questions

What is the IUPAC name of (2-hydroxy-3-methoxyphenyl) carbamate?
The IUPAC name of (2-hydroxy-3-methoxyphenyl) carbamate (CID 68617707) is (2-hydroxy-3-methoxyphenyl) carbamate.
What is the SMILES notation for (2-hydroxy-3-methoxyphenyl) carbamate?
The canonical SMILES for (2-hydroxy-3-methoxyphenyl) carbamate is COc1cccc(OC(N)=O)c1O.
What is the InChIKey of (2-hydroxy-3-methoxyphenyl) carbamate?
The InChIKey is GWCBDSXJOWYBKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO4/c1-12-5-3-2-4-6(7(5)10)13-8(9)11/h2-4,10H,1H3,(H2,9,11).
What are the key properties of (2-hydroxy-3-methoxyphenyl) carbamate?
(2-hydroxy-3-methoxyphenyl) carbamate has a molecular weight of 183.16 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxy-3-methoxyphenyl) carbamate is sourced from PubChem (CID 68617707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).