[2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine

C16H32N2O — CID 106586356

IUPAC[2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine
SMILESCCC1CCCCC1(CN)N1CCCC(COC)C1
InChIInChI=1S/C16H32N2O/c1-3-15-8-4-5-9-16(15,13-17)18-10-6-7-14(11-18)12-19-2/h14-15H,3-13,17H2,1-2H3
InChIKeyQWOFUJZOPVBNAH-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.64
Rot. Bonds5

About [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine

[2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine (PubChem CID 106586356) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine.

Molecular Properties

Compound Name[2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine
PubChem CID106586356
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name[2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine
SMILESCCC1CCCCC1(CN)N1CCCC(COC)C1
InChIInChI=1S/C16H32N2O/c1-3-15-8-4-5-9-16(15,13-17)18-10-6-7-14(11-18)12-19-2/h14-15H,3-13,17H2,1-2H3
InChIKeyQWOFUJZOPVBNAH-UHFFFAOYSA-N
XLogP2.64
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(3,4-dimethylpyrrolidin-1-yl)-2-ethylcyclohexyl]methanamine
CID 79188119
[2-ethyl-1-(3-methoxy-3-methylpiperidin-1-yl)cyclopentyl]methanamine
CID 107391328
[1-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexyl]methanamine
CID 64569292
[1-(4-ethoxypiperidin-1-yl)-2-ethylcyclopentyl]methanamine
CID 113483717
[1-[3-(methoxymethyl)piperidin-1-yl]-3,3-dimethylcyclohexyl]methanamine
CID 106586385
[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine
CID 43584374
[1-[3-(methoxymethyl)pyrrolidin-1-yl]-4-propylcycloheptyl]methanamine
CID 65089250
[1-(3-ethylpiperidin-1-yl)-2,4,4-trimethylcyclohexyl]methanamine
CID 81320901
[3-(3-ethylpiperidin-1-yl)-1-azabicyclo[2.2.2]octan-3-yl]methanamine
CID 43584395
[1-(3-tert-butylpyrrolidin-1-yl)-2-methoxycyclohexyl]methanamine
CID 106872730
[3-[4-(methoxymethyl)piperidin-1-yl]-2-methylthian-3-yl]methanamine
CID 79951432
[4-[3-(methoxymethyl)pyrrolidin-1-yl]-1,1-dioxothian-4-yl]methanamine
CID 64568494

Frequently Asked Questions

What is the IUPAC name of [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine?
The IUPAC name of [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine (CID 106586356) is [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine.
What is the SMILES notation for [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine?
The canonical SMILES for [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine is CCC1CCCCC1(CN)N1CCCC(COC)C1.
What is the InChIKey of [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine?
The InChIKey is QWOFUJZOPVBNAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-15-8-4-5-9-16(15,13-17)18-10-6-7-14(11-18)12-19-2/h14-15H,3-13,17H2,1-2H3.
What are the key properties of [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine?
[2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine has a molecular weight of 268.44 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanamine is sourced from PubChem (CID 106586356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).