3-(ethylamino)-4-methylphenol

C9H13NO — CID 8428

IUPAC3-(ethylamino)-4-methylphenol
SMILESCCNc1cc(O)ccc1C
InChIInChI=1S/C9H13NO/c1-3-10-9-6-8(11)5-4-7(9)2/h4-6,10-11H,3H2,1-2H3
InChIKeyCTGSQPRDMHCIMM-UHFFFAOYSA-N
MW151.21 g/mol
LogP2.13
Rot. Bonds2

About 3-(ethylamino)-4-methylphenol

3-(ethylamino)-4-methylphenol (PubChem CID 8428) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 3-(ethylamino)-4-methylphenol.

Molecular Properties

Compound Name3-(ethylamino)-4-methylphenol
PubChem CID8428
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name3-(ethylamino)-4-methylphenol
SMILESCCNc1cc(O)ccc1C
InChIInChI=1S/C9H13NO/c1-3-10-9-6-8(11)5-4-7(9)2/h4-6,10-11H,3H2,1-2H3
InChIKeyCTGSQPRDMHCIMM-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

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Related Compounds

Edrophonium
CID 3202
3-(Diethylamino)phenol
CID 7062
2(1H)-Quinolone, 7-hydroxy-4-methyl-
CID 5374442
5-(2-Hydroxyethylamino)-2-methylphenol
CID 134396
4-(Benzylamino)phenol
CID 7637
Alpha-(meta-toluidino)-ortho-cresol
CID 3236648
Alpha-(para-toluidino)-ortho-cresol
CID 4114014
3-Ethylaminophenol
CID 578991
3-Dimethylamino-4-methylphenol
CID 8389
3-Amino-p-cresol
CID 17820
N,N-Dibutyl-3-aminophenol
CID 601234
[11C]4-N-methylamino-4-hydroxystilbene
CID 5702297

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-4-methylphenol?
The IUPAC name of 3-(ethylamino)-4-methylphenol (CID 8428) is 3-(ethylamino)-4-methylphenol.
What is the SMILES notation for 3-(ethylamino)-4-methylphenol?
The canonical SMILES for 3-(ethylamino)-4-methylphenol is CCNc1cc(O)ccc1C.
What is the InChIKey of 3-(ethylamino)-4-methylphenol?
The InChIKey is CTGSQPRDMHCIMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-10-9-6-8(11)5-4-7(9)2/h4-6,10-11H,3H2,1-2H3.
What are the key properties of 3-(ethylamino)-4-methylphenol?
3-(ethylamino)-4-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 3-(ethylamino)-4-methylphenol is sourced from PubChem (CID 8428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).