2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol

C13H30N2O — CID 62260772

IUPAC2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol
SMILESCCCN(CCO)CC(C)(CCC)CNC
InChIInChI=1S/C13H30N2O/c1-5-7-13(3,11-14-4)12-15(8-6-2)9-10-16/h14,16H,5-12H2,1-4H3
InChIKeyUOKTYQGYOQJCEE-UHFFFAOYSA-N
MW230.40 g/mol
LogP1.72
Rot. Bonds10

About 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol

2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol (PubChem CID 62260772) has the molecular formula C13H30N2O and a molecular weight of 230.40 g/mol. Its IUPAC name is 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol.

Molecular Properties

Compound Name2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol
PubChem CID62260772
Molecular FormulaC13H30N2O
Molecular Weight230.40 g/mol
Exact Mass230.24
IUPAC Name2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol
SMILESCCCN(CCO)CC(C)(CCC)CNC
InChIInChI=1S/C13H30N2O/c1-5-7-13(3,11-14-4)12-15(8-6-2)9-10-16/h14,16H,5-12H2,1-4H3
InChIKeyUOKTYQGYOQJCEE-UHFFFAOYSA-N
XLogP1.72
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.40
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N',2-dimethyl-N,N,2-tripropylpropane-1,3-diamine
CID 62264130
2-[[2-methyl-2-(propylaminomethyl)pentyl]-propylamino]ethanol
CID 62260774
N,2-dimethyl-N',2-dipropyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62256908
2-[[2-[(tert-butylamino)methyl]-2-methylpentyl]-ethylamino]ethanol
CID 55051933
2-[cyclopropyl-[2-methyl-2-(methylaminomethyl)pentyl]amino]ethanol
CID 62270068
2-[butyl-[2-methyl-2-[(propan-2-ylamino)methyl]pentyl]amino]ethanol
CID 62256428
N-tert-butyl-N'-[2-(dimethylamino)ethyl]-2-methyl-N',2-dipropylpropane-1,3-diamine
CID 62261172
2-[(3-bromo-2,2-dimethylpropyl)-propylamino]ethanol
CID 64999932
N,N',2-trimethyl-N'-(2-methylbutan-2-yl)-2-propylpropane-1,3-diamine
CID 63967395
1-[methyl-[2-methyl-2-(methylaminomethyl)pentyl]amino]propan-2-ol
CID 62337356
N,N',2-trimethyl-N'-(2-methylsulfanylethyl)-2-propylpropane-1,3-diamine
CID 112664642
1-(dipropylamino)-2-methylpentan-2-ol
CID 106291211

Frequently Asked Questions

What is the IUPAC name of 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol?
The IUPAC name of 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol (CID 62260772) is 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol.
What is the SMILES notation for 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol?
The canonical SMILES for 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol is CCCN(CCO)CC(C)(CCC)CNC.
What is the InChIKey of 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol?
The InChIKey is UOKTYQGYOQJCEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O/c1-5-7-13(3,11-14-4)12-15(8-6-2)9-10-16/h14,16H,5-12H2,1-4H3.
What are the key properties of 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol?
2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol has a molecular weight of 230.40 g/mol, XLogP of 1.72, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-methyl-2-(methylaminomethyl)pentyl]-propylamino]ethanol is sourced from PubChem (CID 62260772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).