2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol

C15H24N2O — CID 62547685

IUPAC2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol
SMILESCN1CCCC(N(C)CC(O)c2ccccc2)C1
InChIInChI=1S/C15H24N2O/c1-16-10-6-9-14(11-16)17(2)12-15(18)13-7-4-3-5-8-13/h3-5,7-8,14-15,18H,6,9-12H2,1-2H3
InChIKeyOVKMMAYVHJKHEE-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.75
Rot. Bonds4

About 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol

2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol (PubChem CID 62547685) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol.

Molecular Properties

Compound Name2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol
PubChem CID62547685
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol
SMILESCN1CCCC(N(C)CC(O)c2ccccc2)C1
InChIInChI=1S/C15H24N2O/c1-16-10-6-9-14(11-16)17(2)12-15(18)13-7-4-3-5-8-13/h3-5,7-8,14-15,18H,6,9-12H2,1-2H3
InChIKeyOVKMMAYVHJKHEE-UHFFFAOYSA-N
XLogP1.75
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-2-[methyl-[(3S)-1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]-1-phenylethanol
CID 100838546
(1R)-2-[methyl-[(3S)-1-(6-methylpyridazin-3-yl)piperidin-3-yl]amino]-1-phenylethanol
CID 95764452
1-(2-fluorophenyl)-3-[methyl-(1-methylpiperidin-3-yl)amino]propan-1-ol
CID 62631209
N-methyl-N-(1-methylpiperidin-3-yl)-1-phenylethane-1,2-diamine
CID 62546739
N',2,2-trimethyl-N'-(1-methylpiperidin-3-yl)-1-phenylpropane-1,3-diamine
CID 63193569
N-benzyl-N,1-dimethylpiperidin-3-amine;ethane
CID 142272680
N,N'-dimethyl-N-(1-methylpiperidin-3-yl)-1-phenylethane-1,2-diamine
CID 55084951
4-amino-1-[methyl-(1-methylpiperidin-3-yl)amino]butan-2-ol
CID 117039168
2-[[methyl-(1-methylpiperidin-3-yl)amino]methyl]butanedioic acid
CID 115144584
1-(2-methoxy-5-methylphenyl)-2-[methyl-(1-methylpiperidin-3-yl)amino]ethanol
CID 62545228
1-methoxy-3-[methyl-(1-methylpiperidin-3-yl)amino]propan-2-ol
CID 63930037
2-[cyclopropylmethyl(methyl)amino]-1-phenylethanol
CID 60971117

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol?
The IUPAC name of 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol (CID 62547685) is 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol.
What is the SMILES notation for 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol?
The canonical SMILES for 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol is CN1CCCC(N(C)CC(O)c2ccccc2)C1.
What is the InChIKey of 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol?
The InChIKey is OVKMMAYVHJKHEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-16-10-6-9-14(11-16)17(2)12-15(18)13-7-4-3-5-8-13/h3-5,7-8,14-15,18H,6,9-12H2,1-2H3.
What are the key properties of 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol?
2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol has a molecular weight of 248.37 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(1-methylpiperidin-3-yl)amino]-1-phenylethanol is sourced from PubChem (CID 62547685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).