1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine

C15H30N2 — CID 64678910

IUPAC1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine
SMILESNC1(CCN2CCCCCCC2)CCCCC1
InChIInChI=1S/C15H30N2/c16-15(9-5-4-6-10-15)11-14-17-12-7-2-1-3-8-13-17/h1-14,16H2
InChIKeyBVTGRGQSRPANGO-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.30
Rot. Bonds3

About 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine

1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine (PubChem CID 64678910) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine
PubChem CID64678910
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine
SMILESNC1(CCN2CCCCCCC2)CCCCC1
InChIInChI=1S/C15H30N2/c16-15(9-5-4-6-10-15)11-14-17-12-7-2-1-3-8-13-17/h1-14,16H2
InChIKeyBVTGRGQSRPANGO-UHFFFAOYSA-N
XLogP3.30
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(4-methylpiperazin-1-yl)ethyl]cyclobutan-1-amine
CID 79854675
1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclopentan-1-amine
CID 64677709
1-methyl-3-(2-pyrrolidin-1-ylethyl)piperidin-3-amine
CID 84734630
1-[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethyl]cyclobutan-1-amine
CID 79841857
1-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]cyclohexan-1-amine
CID 64682054
1-[2-(4-ethylazepan-1-yl)ethyl]cyclopentan-1-amine
CID 64681225
1-[2-(1-aminocyclopentyl)ethyl]-N,N-dimethylpiperidin-4-amine
CID 64677916
1-[2-(1-oxo-1,4-thiazinan-4-yl)ethyl]cyclobutan-1-amine
CID 79844518
1-[2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethyl]cyclohexan-1-amine
CID 64682905
1-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclohexan-1-amine
CID 64680158
1-[2-(4-cyclopropylpiperazin-1-yl)ethyl]cyclobutan-1-amine
CID 79842271
1-[2-(1,3-dihydroisoindol-2-yl)ethyl]cyclohexan-1-amine
CID 18630970

Frequently Asked Questions

What is the IUPAC name of 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine (CID 64678910) is 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine is NC1(CCN2CCCCCCC2)CCCCC1.
What is the InChIKey of 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine?
The InChIKey is BVTGRGQSRPANGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c16-15(9-5-4-6-10-15)11-14-17-12-7-2-1-3-8-13-17/h1-14,16H2.
What are the key properties of 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine?
1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(azocan-1-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 64678910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).