4-(ethylamino)-3-methylphenol

C9H13NO — CID 21118573

IUPAC4-(ethylamino)-3-methylphenol
SMILESCCNc1ccc(O)cc1C
InChIInChI=1S/C9H13NO/c1-3-10-9-5-4-8(11)6-7(9)2/h4-6,10-11H,3H2,1-2H3
InChIKeyVNZAHNNZLAXCKE-UHFFFAOYSA-N
MW151.21 g/mol
LogP2.13
Rot. Bonds2

About 4-(ethylamino)-3-methylphenol

4-(ethylamino)-3-methylphenol (PubChem CID 21118573) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 4-(ethylamino)-3-methylphenol.

Molecular Properties

Compound Name4-(ethylamino)-3-methylphenol
PubChem CID21118573
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name4-(ethylamino)-3-methylphenol
SMILESCCNc1ccc(O)cc1C
InChIInChI=1S/C9H13NO/c1-3-10-9-5-4-8(11)6-7(9)2/h4-6,10-11H,3H2,1-2H3
InChIKeyVNZAHNNZLAXCKE-UHFFFAOYSA-N
XLogP2.13
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-(ethylamino)-3-methylphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

potassium;3-(ethylamino)-4-methylphenol;hydride
CID 175099519
1-N,4-N-diethyl-2-methylbenzene-1,4-diamine
CID 18957572
4-bromo-N-ethyl-2-methylaniline
CID 23053407
4-chloro-3-(ethylamino)phenol
CID 146310841
4-(ethylamino)-2-methylbenzene-1,3-diol;naphthalene-2,7-diol
CID 174800015
3-(ethylamino)-2,6-dimethylphenol
CID 43741904
methyl 4-(ethylamino)-3-methylbenzoate
CID 43730612
N-ethylethanamine;2-methylbenzene-1,4-diol;hydrobromide
CID 20502809
N-(2,6-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
CID 63210459
3-methyl-4-[(5-methyloxolan-2-yl)methylamino]phenol
CID 82835467
zinc;4-(ethylamino)-3-methylbenzenediazonium;tetrachloride
CID 170844651
CID 175798397
CID 175798397

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-3-methylphenol?
The IUPAC name of 4-(ethylamino)-3-methylphenol (CID 21118573) is 4-(ethylamino)-3-methylphenol.
What is the SMILES notation for 4-(ethylamino)-3-methylphenol?
The canonical SMILES for 4-(ethylamino)-3-methylphenol is CCNc1ccc(O)cc1C.
What is the InChIKey of 4-(ethylamino)-3-methylphenol?
The InChIKey is VNZAHNNZLAXCKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-10-9-5-4-8(11)6-7(9)2/h4-6,10-11H,3H2,1-2H3.
What are the key properties of 4-(ethylamino)-3-methylphenol?
4-(ethylamino)-3-methylphenol has a molecular weight of 151.21 g/mol, XLogP of 2.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-3-methylphenol is sourced from PubChem (CID 21118573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).