ethylcyclobutane;methanamine

C7H17N — CID 175532329

IUPACethylcyclobutane;methanamine
SMILESCCC1CCC1.CN
InChIInChI=1S/C6H12.CH5N/c1-2-6-4-3-5-6;1-2/h6H,2-5H2,1H3;2H2,1H3
InChIKeyDOCWVGDYSFMLEJ-UHFFFAOYSA-N
MW115.22 g/mol
LogP1.77
Rot. Bonds1

About ethylcyclobutane;methanamine

ethylcyclobutane;methanamine (PubChem CID 175532329) has the molecular formula C7H17N and a molecular weight of 115.22 g/mol. Its IUPAC name is ethylcyclobutane;methanamine.

Molecular Properties

Compound Nameethylcyclobutane;methanamine
PubChem CID175532329
Molecular FormulaC7H17N
Molecular Weight115.22 g/mol
Exact Mass115.14
IUPAC Nameethylcyclobutane;methanamine
SMILESCCC1CCC1.CN
InChIInChI=1S/C6H12.CH5N/c1-2-6-4-3-5-6;1-2/h6H,2-5H2,1H3;2H2,1H3
InChIKeyDOCWVGDYSFMLEJ-UHFFFAOYSA-N
XLogP1.77
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.22
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethylcyclopentane;methanamine
CID 142068671
cyclopropane;ethylcyclobutane;propane
CID 142456817
(5S)-5-ethylcyclononan-1-amine
CID 163875041
ethane;ethene;ethylcyclobutane
CID 164586585
ethylcyclopentane;methane
CID 143390575
tris(ethylcyclopentane);gadolinium
CID 160752471
cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
CID 159227929
chromium;bis(ethylcyclopentane)
CID 91996240
ethane;bis(ethylcyclopentane)
CID 158911237
magnesium;carbanide;bis(ethylcyclopentane)
CID 121233150
carbanide;bis(ethylcyclopentane);tungsten dihydride
CID 164887185
5-ethylcyclooctan-1-ol
CID 19931411

Frequently Asked Questions

What is the IUPAC name of ethylcyclobutane;methanamine?
The IUPAC name of ethylcyclobutane;methanamine (CID 175532329) is ethylcyclobutane;methanamine.
What is the SMILES notation for ethylcyclobutane;methanamine?
The canonical SMILES for ethylcyclobutane;methanamine is CCC1CCC1.CN.
What is the InChIKey of ethylcyclobutane;methanamine?
The InChIKey is DOCWVGDYSFMLEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.CH5N/c1-2-6-4-3-5-6;1-2/h6H,2-5H2,1H3;2H2,1H3.
What are the key properties of ethylcyclobutane;methanamine?
ethylcyclobutane;methanamine has a molecular weight of 115.22 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethylcyclobutane;methanamine is sourced from PubChem (CID 175532329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).