2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol

C14H28N2O — CID 64929004

IUPAC2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol
SMILESCN1CCCC(CNCC2CCCCC2O)C1
InChIInChI=1S/C14H28N2O/c1-16-8-4-5-12(11-16)9-15-10-13-6-2-3-7-14(13)17/h12-15,17H,2-11H2,1H3
InChIKeyXYNBFWXRQMZWBU-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.47
Rot. Bonds4

About 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol

2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol (PubChem CID 64929004) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol
PubChem CID64929004
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol
SMILESCN1CCCC(CNCC2CCCCC2O)C1
InChIInChI=1S/C14H28N2O/c1-16-8-4-5-12(11-16)9-15-10-13-6-2-3-7-14(13)17/h12-15,17H,2-11H2,1H3
InChIKeyXYNBFWXRQMZWBU-UHFFFAOYSA-N
XLogP1.47
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-methylpiperidin-3-yl)-N-[(1-methylpyrrolidin-3-yl)methyl]methanamine
CID 62659433
(E)-N-[(1-methylpiperidin-3-yl)methyl]but-2-en-1-amine
CID 107898888
3-chloro-N-[(1-methylpiperidin-3-yl)methyl]propan-1-amine
CID 115215684
[2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol
CID 106359457
2-[[2-(1-methylpiperidin-2-yl)ethylamino]methyl]cyclohexan-1-ol
CID 64912841
2,2-difluoro-3-[(1-methylpiperidin-3-yl)methylamino]propan-1-ol
CID 106172829
N-[(1-methylpiperidin-3-yl)methyl]pent-3-yn-1-amine
CID 104806624
2-[(3R)-1-methylpiperidin-3-yl]acetic acid
CID 67245614
N'-hydroxy-4-[(1-methylpiperidin-3-yl)methylamino]butanimidamide
CID 77032158
1-(1-methylpiperidin-3-yl)-N-(1H-pyrrol-3-ylmethyl)methanamine
CID 66410289
N-[2-methyl-1-[(1-methylpiperidin-3-yl)methylamino]propan-2-yl]methanesulfonamide
CID 63864960
[1-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclopentyl]methanol
CID 113293535

Frequently Asked Questions

What is the IUPAC name of 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol?
The IUPAC name of 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol (CID 64929004) is 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol is CN1CCCC(CNCC2CCCCC2O)C1.
What is the InChIKey of 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol?
The InChIKey is XYNBFWXRQMZWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-16-8-4-5-12(11-16)9-15-10-13-6-2-3-7-14(13)17/h12-15,17H,2-11H2,1H3.
What are the key properties of 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol?
2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1-methylpiperidin-3-yl)methylamino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 64929004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).