(5-hydroxy-2-methylphenyl) carbamate

C8H9NO3 — CID 68724844

IUPAC(5-hydroxy-2-methylphenyl) carbamate
SMILESCc1ccc(O)cc1OC(N)=O
InChIInChI=1S/C8H9NO3/c1-5-2-3-6(10)4-7(5)12-8(9)11/h2-4,10H,1H3,(H2,9,11)
InChIKeyZYIPFORYMYOWQN-UHFFFAOYSA-N
MW167.16 g/mol
LogP1.16
Rot. Bonds1

About (5-hydroxy-2-methylphenyl) carbamate

(5-hydroxy-2-methylphenyl) carbamate (PubChem CID 68724844) has the molecular formula C8H9NO3 and a molecular weight of 167.16 g/mol. Its IUPAC name is (5-hydroxy-2-methylphenyl) carbamate.

Molecular Properties

Compound Name(5-hydroxy-2-methylphenyl) carbamate
PubChem CID68724844
Molecular FormulaC8H9NO3
Molecular Weight167.16 g/mol
Exact Mass167.06
IUPAC Name(5-hydroxy-2-methylphenyl) carbamate
SMILESCc1ccc(O)cc1OC(N)=O
InChIInChI=1S/C8H9NO3/c1-5-2-3-6(10)4-7(5)12-8(9)11/h2-4,10H,1H3,(H2,9,11)
InChIKeyZYIPFORYMYOWQN-UHFFFAOYSA-N
XLogP1.16
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.16
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-hydroxy-2-methylphenyl) carbamate?
The IUPAC name of (5-hydroxy-2-methylphenyl) carbamate (CID 68724844) is (5-hydroxy-2-methylphenyl) carbamate.
What is the SMILES notation for (5-hydroxy-2-methylphenyl) carbamate?
The canonical SMILES for (5-hydroxy-2-methylphenyl) carbamate is Cc1ccc(O)cc1OC(N)=O.
What is the InChIKey of (5-hydroxy-2-methylphenyl) carbamate?
The InChIKey is ZYIPFORYMYOWQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO3/c1-5-2-3-6(10)4-7(5)12-8(9)11/h2-4,10H,1H3,(H2,9,11).
What are the key properties of (5-hydroxy-2-methylphenyl) carbamate?
(5-hydroxy-2-methylphenyl) carbamate has a molecular weight of 167.16 g/mol, XLogP of 1.16, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-hydroxy-2-methylphenyl) carbamate is sourced from PubChem (CID 68724844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).