[1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol

C17H34N2O — CID 81419423

IUPAC[1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol
SMILESCC(CNCC1(CO)CCCCC1)CN1CCCCC1
InChIInChI=1S/C17H34N2O/c1-16(13-19-10-6-3-7-11-19)12-18-14-17(15-20)8-4-2-5-9-17/h16,18,20H,2-15H2,1H3
InChIKeyZDQSMHRFCJIWPX-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.64
Rot. Bonds7

About [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol

[1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol (PubChem CID 81419423) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol
PubChem CID81419423
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name[1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol
SMILESCC(CNCC1(CO)CCCCC1)CN1CCCCC1
InChIInChI=1S/C17H34N2O/c1-16(13-19-10-6-3-7-11-19)12-18-14-17(15-20)8-4-2-5-9-17/h16,18,20H,2-15H2,1H3
InChIKeyZDQSMHRFCJIWPX-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol with MolForge

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Related Compounds

[1-[[2-(azepan-1-yl)ethylamino]methyl]cyclohexyl]methanol
CID 81419818
[1-[(2-ethylbutylamino)methyl]cyclohexyl]methanol
CID 112703676
(2R)-1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]propan-2-ol
CID 106932098
[1-[[[2-(dimethylamino)-3-methylbutyl]amino]methyl]cyclohexyl]methanol
CID 81412012
2-methyl-N-[1-(1-methylcyclopropyl)ethyl]-3-piperidin-1-ylpropan-1-amine
CID 54906710
2-methyl-3-pyrrolidin-1-yl-N-(2-pyrrolidin-1-ylethyl)propan-1-amine
CID 107911598
N-(2-methyl-3-piperidin-1-ylpropyl)formamide
CID 64992840
[1-(azepan-1-ylmethyl)cyclohexyl]methanol
CID 62270892
2-(1-hydroxycyclohexyl)-N-(2-methyl-3-piperidin-1-ylpropyl)acetamide
CID 111331945
[1-[[2-(1-methylpiperidin-2-yl)ethylamino]methyl]cyclohexyl]methanol
CID 103966435
N-butyl-2-methyl-3-pyrrolidin-1-ylpropan-1-amine
CID 60957473
N-(2-methyl-3-piperidin-1-ylpropyl)octan-1-amine
CID 55191409

Frequently Asked Questions

What is the IUPAC name of [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol (CID 81419423) is [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol is CC(CNCC1(CO)CCCCC1)CN1CCCCC1.
What is the InChIKey of [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol?
The InChIKey is ZDQSMHRFCJIWPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-16(13-19-10-6-3-7-11-19)12-18-14-17(15-20)8-4-2-5-9-17/h16,18,20H,2-15H2,1H3.
What are the key properties of [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol?
[1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol has a molecular weight of 282.47 g/mol, XLogP of 2.64, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 81419423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).