[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine

C16H32N2 — CID 43584374

IUPAC[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine
SMILESCCC1CCCN(C2(CN)CCCCCCC2)C1
InChIInChI=1S/C16H32N2/c1-2-15-9-8-12-18(13-15)16(14-17)10-6-4-3-5-7-11-16/h15H,2-14,17H2,1H3
InChIKeyPULUESCZOSEYQN-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.55
Rot. Bonds3

About [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine

[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine (PubChem CID 43584374) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine.

Molecular Properties

Compound Name[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine
PubChem CID43584374
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine
SMILESCCC1CCCN(C2(CN)CCCCCCC2)C1
InChIInChI=1S/C16H32N2/c1-2-15-9-8-12-18(13-15)16(14-17)10-6-4-3-5-7-11-16/h15H,2-14,17H2,1H3
InChIKeyPULUESCZOSEYQN-UHFFFAOYSA-N
XLogP3.55
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-tert-butyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
CID 43584372
[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
CID 64625427
[1-(3-propylpyrrolidin-1-yl)cycloheptyl]methanamine
CID 113417185
[2-(3-ethylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
CID 43809104
[1-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexyl]methanamine
CID 64569292
[1-(3-ethylpyrrolidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429133
1-[1-(aminomethyl)-4-ethylcycloheptyl]-N,N-dimethylpyrrolidin-3-amine
CID 65088382
[1-(3-ethylpyrrolidin-1-yl)-3-methoxycyclohexyl]methanamine
CID 106872732
(1-piperidin-1-ylcycloheptyl)methanamine
CID 24703148
[1-[(3-ethylpiperidin-1-yl)methyl]cyclohexyl]methanamine
CID 62257531
[1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)cyclooctyl]methanamine
CID 79937680
[1-(3-ethylpiperidin-1-yl)-2,4,4-trimethylcyclohexyl]methanamine
CID 81320901

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine?
The IUPAC name of [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine (CID 43584374) is [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine.
What is the SMILES notation for [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine?
The canonical SMILES for [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine is CCC1CCCN(C2(CN)CCCCCCC2)C1.
What is the InChIKey of [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine?
The InChIKey is PULUESCZOSEYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-2-15-9-8-12-18(13-15)16(14-17)10-6-4-3-5-7-11-16/h15H,2-14,17H2,1H3.
What are the key properties of [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine?
[1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine has a molecular weight of 252.45 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethylpiperidin-1-yl)cyclooctyl]methanamine is sourced from PubChem (CID 43584374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).