2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol

C12H20N2O — CID 24975028

IUPAC2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol
SMILESCN(C)CC(O)c1ccc(N(C)C)cc1
InChIInChI=1S/C12H20N2O/c1-13(2)9-12(15)10-5-7-11(8-6-10)14(3)4/h5-8,12,15H,9H2,1-4H3
InChIKeyRVPIPSNMXLDCHD-UHFFFAOYSA-N
MW208.30 g/mol
LogP1.35
Rot. Bonds4

About 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol

2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol (PubChem CID 24975028) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol.

Molecular Properties

Compound Name2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol
PubChem CID24975028
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol
SMILESCN(C)CC(O)c1ccc(N(C)C)cc1
InChIInChI=1S/C12H20N2O/c1-13(2)9-12(15)10-5-7-11(8-6-10)14(3)4/h5-8,12,15H,9H2,1-4H3
InChIKeyRVPIPSNMXLDCHD-UHFFFAOYSA-N
XLogP1.35
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

4-[1-chloro-2-(dimethylamino)ethyl]-N,N-dimethylaniline
CID 82215480
1-[4-(dimethylamino)phenyl]-2-isocyanoethanol
CID 3911406
(3R)-3-[4-(dimethylamino)phenyl]-3-hydroxypropanoic acid
CID 95440369
1-[4-(dimethylamino)phenyl]-3-ethylpentan-1-ol
CID 82927874
2-cyclopentyl-1-[4-(dimethylamino)phenyl]ethanol
CID 65151167
1-[4-(dimethylamino)phenyl]hex-5-en-1-ol
CID 105102029
1-[4-(dimethylamino)phenyl]-2-thiophen-3-ylethanol
CID 65151020
2-[[2-[4-(dimethylamino)phenyl]-2-hydroxyethyl]amino]acetic acid
CID 82315419
2-(dimethylamino)-1-naphthalen-2-ylethanol
CID 60981028
(1S)-1-(3,4-dimethoxyphenyl)-2-(dimethylamino)ethanol
CID 40574216
N'-[2-[4-(dimethylamino)phenyl]-2-hydroxyethyl]-N-(2-methylpropyl)oxamide
CID 90581629
1-[4-(dimethylamino)phenyl]-2-(oxan-4-yl)ethanol
CID 65150488

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol?
The IUPAC name of 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol (CID 24975028) is 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol.
What is the SMILES notation for 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol?
The canonical SMILES for 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol is CN(C)CC(O)c1ccc(N(C)C)cc1.
What is the InChIKey of 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol?
The InChIKey is RVPIPSNMXLDCHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-13(2)9-12(15)10-5-7-11(8-6-10)14(3)4/h5-8,12,15H,9H2,1-4H3.
What are the key properties of 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol?
2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol has a molecular weight of 208.30 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]ethanol is sourced from PubChem (CID 24975028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).