N-(cyclobutylmethyl)ethenamine

C7H13N — CID 144516368

IUPACN-(cyclobutylmethyl)ethenamine
SMILESC=CNCC1CCC1
InChIInChI=1S/C7H13N/c1-2-8-6-7-4-3-5-7/h2,7-8H,1,3-6H2
InChIKeyUXNLSKXKMRXYFC-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.52
Rot. Bonds3

About N-(cyclobutylmethyl)ethenamine

N-(cyclobutylmethyl)ethenamine (PubChem CID 144516368) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is N-(cyclobutylmethyl)ethenamine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)ethenamine
PubChem CID144516368
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC NameN-(cyclobutylmethyl)ethenamine
SMILESC=CNCC1CCC1
InChIInChI=1S/C7H13N/c1-2-8-6-7-4-3-5-7/h2,7-8H,1,3-6H2
InChIKeyUXNLSKXKMRXYFC-UHFFFAOYSA-N
XLogP1.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)ethenamine?
The IUPAC name of N-(cyclobutylmethyl)ethenamine (CID 144516368) is N-(cyclobutylmethyl)ethenamine.
What is the SMILES notation for N-(cyclobutylmethyl)ethenamine?
The canonical SMILES for N-(cyclobutylmethyl)ethenamine is C=CNCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)ethenamine?
The InChIKey is UXNLSKXKMRXYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-2-8-6-7-4-3-5-7/h2,7-8H,1,3-6H2.
What are the key properties of N-(cyclobutylmethyl)ethenamine?
N-(cyclobutylmethyl)ethenamine has a molecular weight of 111.19 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)ethenamine is sourced from PubChem (CID 144516368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).