N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine

C17H34N2O — CID 107392190

IUPACN-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine
SMILESCCNC1CCCCCCC1N1CCCC(C)(OC)C1
InChIInChI=1S/C17H34N2O/c1-4-18-15-10-7-5-6-8-11-16(15)19-13-9-12-17(2,14-19)20-3/h15-16,18H,4-14H2,1-3H3
InChIKeyFCDGBYBAVWUEBL-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.19
Rot. Bonds4

About N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine

N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine (PubChem CID 107392190) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine
PubChem CID107392190
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC NameN-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine
SMILESCCNC1CCCCCCC1N1CCCC(C)(OC)C1
InChIInChI=1S/C17H34N2O/c1-4-18-15-10-7-5-6-8-11-16(15)19-13-9-12-17(2,14-19)20-3/h15-16,18H,4-14H2,1-3H3
InChIKeyFCDGBYBAVWUEBL-UHFFFAOYSA-N
XLogP3.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-pyrrolidin-1-ylcyclododecan-1-amine
CID 63466183
2-(2,2-dimethylpyrrolidin-1-yl)-N-ethylcycloheptan-1-amine
CID 55161540
N-ethyl-2-(4-ethyl-4-methylpiperidin-1-yl)cyclohexan-1-amine
CID 63160766
5-(3-methoxy-3-methylpiperidin-1-yl)-2,2-dimethylcyclopentan-1-ol
CID 107394568
N-ethyl-2-[2-(3-methoxy-3-methylpiperidin-1-yl)ethyl]cyclopentan-1-amine
CID 107391928
N-ethyl-2-(4-methylazepan-1-yl)cycloheptan-1-amine
CID 63624079
4-(3-methoxy-3-methylpiperidin-1-yl)-N-propylcyclohexan-1-amine
CID 107396577
5-(3-methoxy-3-methylpiperidin-1-yl)-2,2-dimethylcyclopentan-1-amine
CID 107391771
1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine
CID 107396240
N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine
CID 63469847
N-ethyl-2-(4-propylpiperidin-1-yl)cycloheptan-1-amine
CID 63469846
N-ethyl-3-[(3-methoxy-3-methylpiperidin-1-yl)methyl]oxan-4-amine
CID 107395161

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine?
The IUPAC name of N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine (CID 107392190) is N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine.
What is the SMILES notation for N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine?
The canonical SMILES for N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine is CCNC1CCCCCCC1N1CCCC(C)(OC)C1.
What is the InChIKey of N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine?
The InChIKey is FCDGBYBAVWUEBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-4-18-15-10-7-5-6-8-11-16(15)19-13-9-12-17(2,14-19)20-3/h15-16,18H,4-14H2,1-3H3.
What are the key properties of N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine?
N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine has a molecular weight of 282.47 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine is sourced from PubChem (CID 107392190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).