4-chloro-2-(ethoxyamino)phenol

C8H10ClNO2 — CID 57300907

IUPAC4-chloro-2-(ethoxyamino)phenol
SMILESCCONc1cc(Cl)ccc1O
InChIInChI=1S/C8H10ClNO2/c1-2-12-10-7-5-6(9)3-4-8(7)11/h3-5,10-11H,2H2,1H3
InChIKeyKXGNVBQFUNACNW-UHFFFAOYSA-N
MW187.63 g/mol
LogP2.41
Rot. Bonds3

About 4-chloro-2-(ethoxyamino)phenol

4-chloro-2-(ethoxyamino)phenol (PubChem CID 57300907) has the molecular formula C8H10ClNO2 and a molecular weight of 187.63 g/mol. Its IUPAC name is 4-chloro-2-(ethoxyamino)phenol.

Molecular Properties

Compound Name4-chloro-2-(ethoxyamino)phenol
PubChem CID57300907
Molecular FormulaC8H10ClNO2
Molecular Weight187.63 g/mol
Exact Mass187.04
IUPAC Name4-chloro-2-(ethoxyamino)phenol
SMILESCCONc1cc(Cl)ccc1O
InChIInChI=1S/C8H10ClNO2/c1-2-12-10-7-5-6(9)3-4-8(7)11/h3-5,10-11H,2H2,1H3
InChIKeyKXGNVBQFUNACNW-UHFFFAOYSA-N
XLogP2.41
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.63
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-2-(ethylamino)phenol
CID 15847212
N-(5-chloro-2-hydroxyphenyl)propane-1-sulfonamide
CID 43114648
N-(5-chloro-2-hydroxyphenyl)-4-ethoxythiophene-3-carboxamide
CID 21315980
ethyl 4-(5-chloro-2-hydroxyanilino)but-2-enoate
CID 91051560
2-[(5-chloro-2-ethoxyanilino)methyl]phenol
CID 54865428
ethyl 3-[(5-chloro-2-hydroxyphenyl)carbamoylamino]propanoate
CID 10334217
N-(5-chloro-2-hydroxyphenyl)methanethioamide
CID 145012471
1-N,3-N,5-N-tris(5-chloro-2-hydroxyphenyl)benzene-1,3,5-tricarboxamide
CID 57074099
4-[(5-chloro-2-methoxyanilino)methyl]-2-ethoxyphenol
CID 28514732
N-(5-chloro-2-hydroxyphenyl)-2-(4-methylphenoxy)acetamide
CID 836090
3-[(5-chloro-2-ethoxyanilino)methyl]benzene-1,2-diol
CID 61319929
N-(5-chloro-2-hydroxyphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 838186

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(ethoxyamino)phenol?
The IUPAC name of 4-chloro-2-(ethoxyamino)phenol (CID 57300907) is 4-chloro-2-(ethoxyamino)phenol.
What is the SMILES notation for 4-chloro-2-(ethoxyamino)phenol?
The canonical SMILES for 4-chloro-2-(ethoxyamino)phenol is CCONc1cc(Cl)ccc1O.
What is the InChIKey of 4-chloro-2-(ethoxyamino)phenol?
The InChIKey is KXGNVBQFUNACNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClNO2/c1-2-12-10-7-5-6(9)3-4-8(7)11/h3-5,10-11H,2H2,1H3.
What are the key properties of 4-chloro-2-(ethoxyamino)phenol?
4-chloro-2-(ethoxyamino)phenol has a molecular weight of 187.63 g/mol, XLogP of 2.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(ethoxyamino)phenol is sourced from PubChem (CID 57300907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).