2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol

C14H24N2O — CID 55098990

IUPAC2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol
SMILESCNC(c1ccccc1)C(C)CN(C)CCO
InChIInChI=1S/C14H24N2O/c1-12(11-16(3)9-10-17)14(15-2)13-7-5-4-6-8-13/h4-8,12,14-15,17H,9-11H2,1-3H3
InChIKeyUTIHDBQUADJJFL-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.51
Rot. Bonds7

About 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol

2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol (PubChem CID 55098990) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol.

Molecular Properties

Compound Name2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol
PubChem CID55098990
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol
SMILESCNC(c1ccccc1)C(C)CN(C)CCO
InChIInChI=1S/C14H24N2O/c1-12(11-16(3)9-10-17)14(15-2)13-7-5-4-6-8-13/h4-8,12,14-15,17H,9-11H2,1-3H3
InChIKeyUTIHDBQUADJJFL-UHFFFAOYSA-N
XLogP1.51
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]pentan-1-ol
CID 107204642
N'-ethyl-N,N',2-trimethyl-1-phenylpropane-1,3-diamine
CID 62619239
N,N',2-trimethyl-N'-(2-methylbutyl)-1-phenylpropane-1,3-diamine
CID 62619073
N,N',N',2-tetramethyl-1-phenylpropane-1,3-diamine
CID 62618717
2-[cyclopentyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol
CID 62618091
2-methyl-3-(methylamino)-3-phenylpropan-1-ol
CID 64813233
1-[[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]methyl]cyclopentan-1-ol
CID 114953543
N'-(furan-2-ylmethyl)-N,N',2-trimethyl-1-phenylpropane-1,3-diamine
CID 62617540
2-[2-anilinopropyl(methyl)amino]ethanol
CID 10954782
N,N',2-trimethyl-N'-(1-methylsulfanylpropan-2-yl)-1-phenylpropane-1,3-diamine
CID 112665001
N,N',2-trimethyl-N'-(oxan-4-ylmethyl)-1-phenylpropane-1,3-diamine
CID 63713541
1-[[3-(ethylamino)-2-methyl-3-phenylpropyl]-methylamino]propan-2-ol
CID 62618624

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol?
The IUPAC name of 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol (CID 55098990) is 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol.
What is the SMILES notation for 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol?
The canonical SMILES for 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol is CNC(c1ccccc1)C(C)CN(C)CCO.
What is the InChIKey of 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol?
The InChIKey is UTIHDBQUADJJFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-12(11-16(3)9-10-17)14(15-2)13-7-5-4-6-8-13/h4-8,12,14-15,17H,9-11H2,1-3H3.
What are the key properties of 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol?
2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol has a molecular weight of 236.36 g/mol, XLogP of 1.51, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[2-methyl-3-(methylamino)-3-phenylpropyl]amino]ethanol is sourced from PubChem (CID 55098990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).