4-[1-(dimethylamino)ethyl]phenol

C10H15NO — CID 3029886

IUPAC4-[1-(dimethylamino)ethyl]phenol
SMILESCC(c1ccc(O)cc1)N(C)C
InChIInChI=1S/C10H15NO/c1-8(11(2)3)9-4-6-10(12)7-5-9/h4-8,12H,1-3H3
InChIKeyBSBYBIFCRACFFD-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.01
Rot. Bonds2

About 4-[1-(dimethylamino)ethyl]phenol

4-[1-(dimethylamino)ethyl]phenol (PubChem CID 3029886) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 4-[1-(dimethylamino)ethyl]phenol.

Molecular Properties

Compound Name4-[1-(dimethylamino)ethyl]phenol
PubChem CID3029886
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name4-[1-(dimethylamino)ethyl]phenol
SMILESCC(c1ccc(O)cc1)N(C)C
InChIInChI=1S/C10H15NO/c1-8(11(2)3)9-4-6-10(12)7-5-9/h4-8,12H,1-3H3
InChIKeyBSBYBIFCRACFFD-UHFFFAOYSA-N
XLogP2.01
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-[(1R)-1-(dimethylamino)ethyl]phenyl]boronic acid
CID 99773385
(1S)-N,N-dimethyl-1-phenylethanamine
CID 2724276
3-[1-(4-hydroxyphenyl)ethyl-methylamino]-2-methylpropanoic acid
CID 65072257
3-[(1R)-1-(dimethylamino)ethyl]phenol
CID 10313270
4-[1-(4-hydroxyphenyl)ethyl]phenol
CID 608116
(1S)-N,N-dimethyl-1-phenylethanamine;hydrochloride
CID 141121906
4-[amino-[hydroxy(methyl)amino]methyl]phenol
CID 146512717
4-[1-[1-methoxypropan-2-yl(methyl)amino]ethyl]phenol
CID 82982525
methane;4-propan-2-ylphenol
CID 159328733
N,N-dimethyl-1-(4-propan-2-yloxyphenyl)ethanamine
CID 116914623
4-[1-(2-fluoro-N-methylanilino)ethyl]phenol
CID 82978305
2-[[(1R)-1-(4-hydroxyphenyl)ethyl]-methylamino]ethyl N,N-dimethylcarbamate
CID 57026280

Frequently Asked Questions

What is the IUPAC name of 4-[1-(dimethylamino)ethyl]phenol?
The IUPAC name of 4-[1-(dimethylamino)ethyl]phenol (CID 3029886) is 4-[1-(dimethylamino)ethyl]phenol.
What is the SMILES notation for 4-[1-(dimethylamino)ethyl]phenol?
The canonical SMILES for 4-[1-(dimethylamino)ethyl]phenol is CC(c1ccc(O)cc1)N(C)C.
What is the InChIKey of 4-[1-(dimethylamino)ethyl]phenol?
The InChIKey is BSBYBIFCRACFFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-8(11(2)3)9-4-6-10(12)7-5-9/h4-8,12H,1-3H3.
What are the key properties of 4-[1-(dimethylamino)ethyl]phenol?
4-[1-(dimethylamino)ethyl]phenol has a molecular weight of 165.24 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(dimethylamino)ethyl]phenol is sourced from PubChem (CID 3029886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).