1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine

C15H30N2 — CID 155056749

IUPAC1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine
SMILESCCC1CCCC(C(N)C(C)C)/C(=C\N)CC1
InChIInChI=1S/C15H30N2/c1-4-12-6-5-7-14(15(17)11(2)3)13(10-16)9-8-12/h10-12,14-15H,4-9,16-17H2,1-3H3/b13-10-
InChIKeyIVOCQVAOVUBKJN-RAXLEYEMSA-N
MW238.42 g/mol
LogP3.42
Rot. Bonds3

About 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine

1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine (PubChem CID 155056749) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine.

Molecular Properties

Compound Name1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine
PubChem CID155056749
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine
SMILESCCC1CCCC(C(N)C(C)C)/C(=C\N)CC1
InChIInChI=1S/C15H30N2/c1-4-12-6-5-7-14(15(17)11(2)3)13(10-16)9-8-12/h10-12,14-15H,4-9,16-17H2,1-3H3/b13-10-
InChIKeyIVOCQVAOVUBKJN-RAXLEYEMSA-N
XLogP3.42
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethylcycloheptyl)-2-methylpropan-1-amine
CID 79298507
2-(4-ethylcycloheptylidene)ethanamine
CID 77055408
2-(4-ethylcyclohexylidene)ethanamine
CID 63970724
ethylcyclobutane;methanamine
CID 175532329
ethylcyclopentane;methanamine
CID 142068671
cyclopropane;ethylcyclobutane;propane
CID 142456817
1-ethyl-4-(3-methylbutyl)cycloheptane
CID 123171853
(2S)-1-cyclobutylpropan-2-amine
CID 66713874
(2R)-1-cyclobutylpropan-2-amine
CID 124506916
(5S)-5-ethylcyclononan-1-amine
CID 163875041
(3-ethylcyclohexyl) (2R)-2-aminopropanoate
CID 78967083
1-(3-ethylcyclohexyl)pentan-3-amine
CID 64504617

Frequently Asked Questions

What is the IUPAC name of 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine?
The IUPAC name of 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine (CID 155056749) is 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine.
What is the SMILES notation for 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine?
The canonical SMILES for 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine is CCC1CCCC(C(N)C(C)C)/C(=C\N)CC1.
What is the InChIKey of 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine?
The InChIKey is IVOCQVAOVUBKJN-RAXLEYEMSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-12-6-5-7-14(15(17)11(2)3)13(10-16)9-8-12/h10-12,14-15H,4-9,16-17H2,1-3H3/b13-10-.
What are the key properties of 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine?
1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 3.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2Z)-2-(aminomethylidene)-5-ethylcyclooctyl]-2-methylpropan-1-amine is sourced from PubChem (CID 155056749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).