1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol

C14H28N2O2 — CID 112622604

IUPAC1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol
SMILESCOC1CCN(CC2(O)CCCCC2)C(CN)C1
InChIInChI=1S/C14H28N2O2/c1-18-13-5-8-16(12(9-13)10-15)11-14(17)6-3-2-4-7-14/h12-13,17H,2-11,15H2,1H3
InChIKeyIUEGRXVQLPMLMQ-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.12
Rot. Bonds4

About 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol

1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol (PubChem CID 112622604) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol
PubChem CID112622604
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol
SMILESCOC1CCN(CC2(O)CCCCC2)C(CN)C1
InChIInChI=1S/C14H28N2O2/c1-18-13-5-8-16(12(9-13)10-15)11-14(17)6-3-2-4-7-14/h12-13,17H,2-11,15H2,1H3
InChIKeyIUEGRXVQLPMLMQ-UHFFFAOYSA-N
XLogP1.12
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

2-[1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclopropyl]acetonitrile
CID 112622488
2-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-1-piperidin-1-ylethanone
CID 112622497
2-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N-cyclopropyl-N-methylacetamide
CID 112622491
2-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 112622666
methyl 3-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-2-methylpropanoate
CID 112622716
2-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N-cycloheptylacetamide
CID 115963763
(4-methoxy-1-nonylpiperidin-2-yl)methanamine
CID 112622577
1-[(2-methylazetidin-1-yl)methyl]cycloheptan-1-ol
CID 104550058
[1-[(4-methoxy-2-methylpiperidin-1-yl)methyl]cyclopentyl]methanamine
CID 114221232
2-[2-(aminomethyl)-4-methoxypiperidin-1-yl]-N-cyclopropylacetamide
CID 112622714
[4-methoxy-1-[3-(2,2,2-trifluoroethoxy)propyl]piperidin-2-yl]methanamine
CID 112622698
[4-methoxy-1-(4,4,4-trifluorobutyl)piperidin-2-yl]methanamine
CID 112622508

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol?
The IUPAC name of 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol (CID 112622604) is 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol is COC1CCN(CC2(O)CCCCC2)C(CN)C1.
What is the InChIKey of 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol?
The InChIKey is IUEGRXVQLPMLMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-18-13-5-8-16(12(9-13)10-15)11-14(17)6-3-2-4-7-14/h12-13,17H,2-11,15H2,1H3.
What are the key properties of 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol?
1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol has a molecular weight of 256.39 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(aminomethyl)-4-methoxypiperidin-1-yl]methyl]cyclohexan-1-ol is sourced from PubChem (CID 112622604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).