2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol

C14H24N2O — CID 63701341

IUPAC2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol
SMILESCc1ccc(C(O)CN(C)CCN(C)C)cc1
InChIInChI=1S/C14H24N2O/c1-12-5-7-13(8-6-12)14(17)11-16(4)10-9-15(2)3/h5-8,14,17H,9-11H2,1-4H3
InChIKeyRNOAQOXWKCCMLF-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.52
Rot. Bonds6

About 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol

2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol (PubChem CID 63701341) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol
PubChem CID63701341
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol
SMILESCc1ccc(C(O)CN(C)CCN(C)C)cc1
InChIInChI=1S/C14H24N2O/c1-12-5-7-13(8-6-12)14(17)11-16(4)10-9-15(2)3/h5-8,14,17H,9-11H2,1-4H3
InChIKeyRNOAQOXWKCCMLF-UHFFFAOYSA-N
XLogP1.52
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(dimethylamino)-1-(4-methylphenyl)propan-1-ol
CID 13013916
1-(3,4-dimethoxyphenyl)-2-[2-(dimethylamino)ethyl-methylamino]ethanol
CID 63699776
2-[3-(dimethylamino)propyl-methylamino]-1-(4-methoxyphenyl)ethanol
CID 63698745
N'-[2-(dimethylamino)ethyl]-N'-methyl-1-(4-methylphenyl)-N-propylethane-1,2-diamine
CID 63693085
2-[3-(dimethylamino)propyl-methylamino]-1-(4-propan-2-yloxyphenyl)ethanol
CID 63699784
1-(3,4-dichlorophenyl)-2-[2-[[2-(3,4-dichlorophenyl)-2-hydroxyethyl]-methylamino]ethyl-methylamino]ethanol
CID 44537014
2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)propan-1-ol
CID 63701171
N'-[2-amino-2-(4-methylphenyl)ethyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63695196
3-[2-(dimethylamino)ethyl-methylamino]-1-phenylpropan-1-ol
CID 63700698
2-[methyl-[(2-methyl-1,2,4-triazol-3-yl)methyl]amino]-1-(4-methylphenyl)ethanol
CID 111512497
1-(4-bromophenyl)-2-[2-methoxyethyl(methyl)amino]ethanol
CID 110935898
2-[2-hydroxyethyl(methyl)amino]-1-[4-(2-methylpropyl)phenyl]ethanol
CID 82217026

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol?
The IUPAC name of 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol (CID 63701341) is 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol?
The canonical SMILES for 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol is Cc1ccc(C(O)CN(C)CCN(C)C)cc1.
What is the InChIKey of 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol?
The InChIKey is RNOAQOXWKCCMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-12-5-7-13(8-6-12)14(17)11-16(4)10-9-15(2)3/h5-8,14,17H,9-11H2,1-4H3.
What are the key properties of 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol?
2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol has a molecular weight of 236.36 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl-methylamino]-1-(4-methylphenyl)ethanol is sourced from PubChem (CID 63701341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).