2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol

C12H26N2O — CID 111105365

IUPAC2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol
SMILESCC(C)CN(CCO)C1CCN(C)CC1
InChIInChI=1S/C12H26N2O/c1-11(2)10-14(8-9-15)12-4-6-13(3)7-5-12/h11-12,15H,4-10H2,1-3H3
InChIKeyPTADDIFOXFXDKN-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.03
Rot. Bonds5

About 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol

2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol (PubChem CID 111105365) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol.

Molecular Properties

Compound Name2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol
PubChem CID111105365
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol
SMILESCC(C)CN(CCO)C1CCN(C)CC1
InChIInChI=1S/C12H26N2O/c1-11(2)10-14(8-9-15)12-4-6-13(3)7-5-12/h11-12,15H,4-10H2,1-3H3
InChIKeyPTADDIFOXFXDKN-UHFFFAOYSA-N
XLogP1.03
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]acetic acid
CID 65063962
6-[cyclopropyl(2-methylpropyl)amino]hexan-1-ol
CID 103737780
6-[cyclopentyl(2-methylpropyl)amino]hexan-1-ol
CID 103737867
N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)propane-2-sulfonamide
CID 64584958
2-[2-methylpropyl-(1-methylpyrrolidin-3-yl)amino]acetic acid
CID 65063911
N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;2-[2-hydroxyethyl(methyl)amino]ethanol
CID 159296161
2-[cyclopentyl(2-methylpentyl)amino]ethanol
CID 62266267
2-[[2-(bromomethyl)-3-methylbutyl]-cyclopropylamino]ethanol
CID 65011905
N'-(1-methylpiperidin-3-yl)-N'-(2-methylpropyl)ethane-1,2-diamine
CID 83821361
3-[cycloheptyl(2-hydroxyethyl)amino]-2-methylpropanoic acid
CID 82329620
2-[cyclohexyl(2-ethylbutyl)amino]ethanol
CID 82930046
3-[cyclobutyl(2-hydroxyethyl)amino]propane-1,2-diol
CID 102867765

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol?
The IUPAC name of 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol (CID 111105365) is 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol.
What is the SMILES notation for 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol?
The canonical SMILES for 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol is CC(C)CN(CCO)C1CCN(C)CC1.
What is the InChIKey of 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol?
The InChIKey is PTADDIFOXFXDKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-11(2)10-14(8-9-15)12-4-6-13(3)7-5-12/h11-12,15H,4-10H2,1-3H3.
What are the key properties of 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol?
2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol has a molecular weight of 214.35 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylpiperidin-4-yl)-(2-methylpropyl)amino]ethanol is sourced from PubChem (CID 111105365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).