(E)-cyclobut-2-en-1-ylidenemethanamine

C5H7N — CID 147295105

IUPAC(E)-cyclobut-2-en-1-ylidenemethanamine
SMILESN/C=C1/C=CC1
InChIInChI=1S/C5H7N/c6-4-5-2-1-3-5/h1-2,4H,3,6H2/b5-4-
InChIKeyCUYSFGYBTMMTSL-PLNGDYQASA-N
MW81.12 g/mol
LogP0.79
Rot. Bonds

About (E)-cyclobut-2-en-1-ylidenemethanamine

(E)-cyclobut-2-en-1-ylidenemethanamine (PubChem CID 147295105) has the molecular formula C5H7N and a molecular weight of 81.12 g/mol. Its IUPAC name is (E)-cyclobut-2-en-1-ylidenemethanamine.

Molecular Properties

Compound Name(E)-cyclobut-2-en-1-ylidenemethanamine
PubChem CID147295105
Molecular FormulaC5H7N
Molecular Weight81.12 g/mol
Exact Mass81.06
IUPAC Name(E)-cyclobut-2-en-1-ylidenemethanamine
SMILESN/C=C1/C=CC1
InChIInChI=1S/C5H7N/c6-4-5-2-1-3-5/h1-2,4H,3,6H2/b5-4-
InChIKeyCUYSFGYBTMMTSL-PLNGDYQASA-N
XLogP0.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50081.12
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(Z)-3H-pyridin-4-ylidenemethanamine
CID 118227677
1-[(Z)-cyclobut-2-en-1-ylidenemethyl]-1-methylhydrazine
CID 160821489
5-[(Z)-cyclobut-2-en-1-ylidenemethyl]cyclopenta-1,3-diene
CID 163468986
(6Z)-6-ethylidene-2-methylcyclohexa-1,3-diene
CID 163873761
2-trimethylsilylcyclopenta-1,3-diene-1-carbaldehyde
CID 15205236
cyclohepta-1,3,5-triene-1,4-diamine
CID 145013911
(6Z)-6-(aminomethylidene)pyridazin-2-ium-1-amine chloride
CID 170692754
cyclopenta-2,4-dien-1-ylidenemethanamine fluoride
CID 139243613
3-bromocyclohexa-2,4-dien-1-one
CID 89488225
[2-(aminomethyl)cyclopenta-1,3-dien-1-yl]methanamine
CID 22286738
heptacyclo[16.6.0.02,9.03,7.010,17.011,15.019,23]tetracosa-1,3(7),4,9,11(15),12,17,19(23),20-nonaene
CID 58130571
(E)-2-(4-propylcyclohepta-1,3,6-trien-1-yl)ethenamine
CID 170054963

Frequently Asked Questions

What is the IUPAC name of (E)-cyclobut-2-en-1-ylidenemethanamine?
The IUPAC name of (E)-cyclobut-2-en-1-ylidenemethanamine (CID 147295105) is (E)-cyclobut-2-en-1-ylidenemethanamine.
What is the SMILES notation for (E)-cyclobut-2-en-1-ylidenemethanamine?
The canonical SMILES for (E)-cyclobut-2-en-1-ylidenemethanamine is N/C=C1/C=CC1.
What is the InChIKey of (E)-cyclobut-2-en-1-ylidenemethanamine?
The InChIKey is CUYSFGYBTMMTSL-PLNGDYQASA-N. The full InChI is InChI=1S/C5H7N/c6-4-5-2-1-3-5/h1-2,4H,3,6H2/b5-4-.
What are the key properties of (E)-cyclobut-2-en-1-ylidenemethanamine?
(E)-cyclobut-2-en-1-ylidenemethanamine has a molecular weight of 81.12 g/mol, XLogP of 0.79, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-cyclobut-2-en-1-ylidenemethanamine is sourced from PubChem (CID 147295105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).