N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine

C9H15N — CID 144514110

IUPACN-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine
SMILESC/C=C(C)\N=C(/C)C1CC1
InChIInChI=1S/C9H15N/c1-4-7(2)10-8(3)9-5-6-9/h4,9H,5-6H2,1-3H3/b7-4-,10-8+
InChIKeyFRMRILNAFADNIR-WIXOJMCHSA-N
MW137.23 g/mol
LogP2.78
Rot. Bonds2

About N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine

N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine (PubChem CID 144514110) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine.

Molecular Properties

Compound NameN-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine
PubChem CID144514110
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC NameN-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine
SMILESC/C=C(C)\N=C(/C)C1CC1
InChIInChI=1S/C9H15N/c1-4-7(2)10-8(3)9-5-6-9/h4,9H,5-6H2,1-3H3/b7-4-,10-8+
InChIKeyFRMRILNAFADNIR-WIXOJMCHSA-N
XLogP2.78
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopropyl-N-prop-1-en-2-ylprop-2-en-1-imine
CID 144912503
N-[(Z)-but-2-en-2-yl]-3-methylpentan-2-imine
CID 155301799
N-[(Z)-but-2-en-2-yl]-2-methylpentan-3-imine
CID 164879240
N-[(Z)-but-2-en-2-yl]-3-methylpentan-2-imine;ethane
CID 177983279
3-methyl-N-prop-1-en-2-ylbutan-2-imine
CID 166088043

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine?
The IUPAC name of N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine (CID 144514110) is N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine.
What is the SMILES notation for N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine?
The canonical SMILES for N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine is C/C=C(C)\N=C(/C)C1CC1.
What is the InChIKey of N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine?
The InChIKey is FRMRILNAFADNIR-WIXOJMCHSA-N. The full InChI is InChI=1S/C9H15N/c1-4-7(2)10-8(3)9-5-6-9/h4,9H,5-6H2,1-3H3/b7-4-,10-8+.
What are the key properties of N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine?
N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine has a molecular weight of 137.23 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-but-2-en-2-yl]-1-cyclopropylethanimine is sourced from PubChem (CID 144514110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).