1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine

C16H26N2 — CID 66446277

IUPAC1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine
SMILESCc1cccnc1CC(N)C1CCCCCCC1
InChIInChI=1S/C16H26N2/c1-13-8-7-11-18-16(13)12-15(17)14-9-5-3-2-4-6-10-14/h7-8,11,14-15H,2-6,9-10,12,17H2,1H3
InChIKeyMCNWABZUMFLLHU-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.62
Rot. Bonds3

About 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine

1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine (PubChem CID 66446277) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine
PubChem CID66446277
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine
SMILESCc1cccnc1CC(N)C1CCCCCCC1
InChIInChI=1S/C16H26N2/c1-13-8-7-11-18-16(13)12-15(17)14-9-5-3-2-4-6-10-14/h7-8,11,14-15H,2-6,9-10,12,17H2,1H3
InChIKeyMCNWABZUMFLLHU-UHFFFAOYSA-N
XLogP3.62
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-2-(3-methyl-2-pyridinyl)ethanamine
CID 66446086
1-cyclooctyl-N-ethyl-2-(3-methyl-2-pyridinyl)ethanamine
CID 66447669
2,2-dicyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine
CID 112650218
N-(2-amino-2-cyclopropylethyl)-2-(3-methyl-2-pyridinyl)acetamide
CID 107148527
N-[(3-methyl-2-pyridinyl)methyl]cyclobutanamine
CID 63305574
1-cyclohexyl-2-(2,6-dimethylphenoxy)ethanamine;hydrochloride
CID 162334204
2-[(3-methyl-2-pyridinyl)methyl]cycloheptan-1-ol
CID 112651216
2-[2-chloro-2-(2,2-dimethylcyclohexyl)ethyl]-3-methylpyridine
CID 107186199
2-[2-bromo-2-(2-methylcyclopentyl)ethyl]-3-methylpyridine
CID 107186225
N-cycloheptyl-2-[methyl-[(2R)-1-(3-methyl-2-pyridinyl)propan-2-yl]amino]acetamide
CID 124850332
1-cyclopentyl-2-pyridin-3-ylethanamine
CID 62553066
2-amino-3-(3-methyl-2-pyridinyl)propanoic acid
CID 3379209

Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine?
The IUPAC name of 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine (CID 66446277) is 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine is Cc1cccnc1CC(N)C1CCCCCCC1.
What is the InChIKey of 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine?
The InChIKey is MCNWABZUMFLLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-13-8-7-11-18-16(13)12-15(17)14-9-5-3-2-4-6-10-14/h7-8,11,14-15H,2-6,9-10,12,17H2,1H3.
What are the key properties of 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine?
1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine has a molecular weight of 246.40 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-2-(3-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 66446277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).