ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate

C10H14N2O3 — CID 70037110

IUPACethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate
SMILESCCOC(=O)Nc1ccc(NC)cc1O
InChIInChI=1S/C10H14N2O3/c1-3-15-10(14)12-8-5-4-7(11-2)6-9(8)13/h4-6,11,13H,3H2,1-2H3,(H,12,14)
InChIKeyZEUYFLISQREIIW-UHFFFAOYSA-N
MW210.23 g/mol
LogP2.00
Rot. Bonds3

About ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate

ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate (PubChem CID 70037110) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate
PubChem CID70037110
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Nameethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate
SMILESCCOC(=O)Nc1ccc(NC)cc1O
InChIInChI=1S/C10H14N2O3/c1-3-15-10(14)12-8-5-4-7(11-2)6-9(8)13/h4-6,11,13H,3H2,1-2H3,(H,12,14)
InChIKeyZEUYFLISQREIIW-UHFFFAOYSA-N
XLogP2.00
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethyl N-[2-hydroxy-5-methoxy-4-(methylamino)phenyl]carbamate
CID 70034657
ethyl N-(3-chloro-4-hydroxyphenyl)carbamate
CID 64787909
ethyl N-[4-methoxy-3-(methylamino)phenyl]carbamate
CID 163895586
methyl 3-(ethoxycarbonylamino)-4-hydroxybenzoate
CID 139715315
ethyl N-[3-(ethoxycarbonylamino)phenyl]carbamate
CID 897252
methyl N-(2-hydroxy-4-methylphenyl)carbamate
CID 61269197
ethane;ethyl N-(4-methylphenyl)carbamate
CID 143199598
ethyl N-(6-hydroxynaphthalen-2-yl)carbamate
CID 68802648
ethyl N-(2-formyl-4-methylphenyl)carbamate
CID 135178172
ethyl N-[4-(ethylamino)-2-nitrophenyl]carbamate
CID 144511742
ethyl N-[2-(3-hydroxyprop-1-ynyl)-4-methylphenyl]carbamate
CID 60813703
3-amino-4-(ethoxycarbonylamino)benzoic acid
CID 63117054

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate?
The IUPAC name of ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate (CID 70037110) is ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate.
What is the SMILES notation for ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate?
The canonical SMILES for ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate is CCOC(=O)Nc1ccc(NC)cc1O.
What is the InChIKey of ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate?
The InChIKey is ZEUYFLISQREIIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-3-15-10(14)12-8-5-4-7(11-2)6-9(8)13/h4-6,11,13H,3H2,1-2H3,(H,12,14).
What are the key properties of ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate?
ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate has a molecular weight of 210.23 g/mol, XLogP of 2.00, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-hydroxy-4-(methylamino)phenyl]carbamate is sourced from PubChem (CID 70037110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).