(Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine

C11H17N — CID 123662889

IUPAC(Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine
SMILESC/C=C(\C=N\C(C)=C1CC1)CC
InChIInChI=1S/C11H17N/c1-4-10(5-2)8-12-9(3)11-6-7-11/h4,8H,5-7H2,1-3H3/b10-4-,12-8+
InChIKeyPGHMUGFTDBBKHD-OZSAWRBNSA-N
MW163.26 g/mol
LogP3.48
Rot. Bonds3

About (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine

(Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine (PubChem CID 123662889) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine.

Molecular Properties

Compound Name(Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine
PubChem CID123662889
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name(Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine
SMILESC/C=C(\C=N\C(C)=C1CC1)CC
InChIInChI=1S/C11H17N/c1-4-10(5-2)8-12-9(3)11-6-7-11/h4,8H,5-7H2,1-3H3/b10-4-,12-8+
InChIKeyPGHMUGFTDBBKHD-OZSAWRBNSA-N
XLogP3.48
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-N-(3-methylpent-2-en-2-yl)-2-(trifluoromethyl)but-2-en-1-imine
CID 153358122
(E)-N-tert-butyl-2-methylpent-2-en-1-imine
CID 10582977
N-(2-methylpent-2-en-1-ylidene)cyclopropan-amine
CID 129748290
N-(2-ethyl-2-hexenylidene)propylamine
CID 129806324
(Z)-N-[(Z)-but-2-en-2-yl]-2-fluoro-3-methylpent-2-en-1-imine
CID 142120575
(E)-2-(2-fluoropropan-2-yl)-N-[(Z)-pent-2-en-2-yl]but-2-en-1-imine
CID 171492856
(Z)-N-tert-butyl-2,4,4-trimethylpent-2-en-1-imine
CID 59179886
N-[(Z)-4,4-dimethylpent-2-en-2-yl]-2,2-dimethylpropan-1-imine
CID 59179900
N-butan-2-yl-2-methylhex-2-en-1-imine
CID 85373398
N-butan-2-yl-2-methylpent-2-en-1-imine
CID 85381401
2-ethyl-N-methylhex-2-en-1-imine
CID 86125258
2-methyl-N-[(Z)-pent-2-en-3-yl]prop-2-en-1-imine
CID 88994507

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine?
The IUPAC name of (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine (CID 123662889) is (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine.
What is the SMILES notation for (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine?
The canonical SMILES for (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine is C/C=C(\C=N\C(C)=C1CC1)CC.
What is the InChIKey of (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine?
The InChIKey is PGHMUGFTDBBKHD-OZSAWRBNSA-N. The full InChI is InChI=1S/C11H17N/c1-4-10(5-2)8-12-9(3)11-6-7-11/h4,8H,5-7H2,1-3H3/b10-4-,12-8+.
What are the key properties of (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine?
(Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine has a molecular weight of 163.26 g/mol, XLogP of 3.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(1-cyclopropylideneethyl)-2-ethylbut-2-en-1-imine is sourced from PubChem (CID 123662889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).