3-(dimethylamino)-4-methylphenol

C9H13NO — CID 8389

IUPAC3-(dimethylamino)-4-methylphenol
SMILESCc1ccc(O)cc1N(C)C
InChIInChI=1S/C9H13NO/c1-7-4-5-8(11)6-9(7)10(2)3/h4-6,11H,1-3H3
InChIKeyZQFUXWBKBSWKON-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.77
Rot. Bonds1

About 3-(dimethylamino)-4-methylphenol

3-(dimethylamino)-4-methylphenol (PubChem CID 8389) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 3-(dimethylamino)-4-methylphenol.

Molecular Properties

Compound Name3-(dimethylamino)-4-methylphenol
PubChem CID8389
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name3-(dimethylamino)-4-methylphenol
SMILESCc1ccc(O)cc1N(C)C
InChIInChI=1S/C9H13NO/c1-7-4-5-8(11)6-9(7)10(2)3/h4-6,11H,1-3H3
InChIKeyZQFUXWBKBSWKON-UHFFFAOYSA-N
XLogP1.77
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Edrophonium Chloride
CID 8307
Edrophonium
CID 3202
3-(Diethylamino)phenol
CID 7062
3-(Dimethylamino)phenol
CID 7421
3-Ethylamino-4-methylphenol
CID 8428
3-Hydroxycarbamazepine
CID 135290
2(1H)-Quinolone, 7-hydroxy-4-methyl-
CID 5374442
Benzenaminium, N-ethyl-3-hydroxy-N,N-dimethyl-, bromide (1:1)
CID 9336
3-Hydroxyphenyltrimethylammonium iodide
CID 17250
3-(4-Benzyl-piperazin-1-yl)-phenol
CID 10015867
3-Amino-p-cresol
CID 17820
N,N-Dibutyl-3-aminophenol
CID 601234

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-4-methylphenol?
The IUPAC name of 3-(dimethylamino)-4-methylphenol (CID 8389) is 3-(dimethylamino)-4-methylphenol.
What is the SMILES notation for 3-(dimethylamino)-4-methylphenol?
The canonical SMILES for 3-(dimethylamino)-4-methylphenol is Cc1ccc(O)cc1N(C)C.
What is the InChIKey of 3-(dimethylamino)-4-methylphenol?
The InChIKey is ZQFUXWBKBSWKON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-7-4-5-8(11)6-9(7)10(2)3/h4-6,11H,1-3H3.
What are the key properties of 3-(dimethylamino)-4-methylphenol?
3-(dimethylamino)-4-methylphenol has a molecular weight of 151.21 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-4-methylphenol is sourced from PubChem (CID 8389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).