N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine

C18H27N — CID 163930533

IUPACN-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine
SMILESC=NC1CC=C(C2CC2CCCC(=C)C2CC2)CC1
InChIInChI=1S/C18H27N/c1-13(14-6-7-14)4-3-5-16-12-18(16)15-8-10-17(19-2)11-9-15/h8,14,16-18H,1-7,9-12H2
InChIKeyRIHMOVJCESCGDF-UHFFFAOYSA-N
MW257.42 g/mol
LogP4.94
Rot. Bonds7

About N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine

N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine (PubChem CID 163930533) has the molecular formula C18H27N and a molecular weight of 257.42 g/mol. Its IUPAC name is N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine.

Molecular Properties

Compound NameN-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine
PubChem CID163930533
Molecular FormulaC18H27N
Molecular Weight257.42 g/mol
Exact Mass257.21
IUPAC NameN-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine
SMILESC=NC1CC=C(C2CC2CCCC(=C)C2CC2)CC1
InChIInChI=1S/C18H27N/c1-13(14-6-7-14)4-3-5-16-12-18(16)15-8-10-17(19-2)11-9-15/h8,14,16-18H,1-7,9-12H2
InChIKeyRIHMOVJCESCGDF-UHFFFAOYSA-N
XLogP4.94
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(4-prop-1-en-2-ylcyclohexyl)cyclohex-3-en-1-yl]methanimine
CID 90899690
N-[1-(3-ethylcyclopropen-1-yl)pent-4-en-2-yl]methanimine
CID 91145112
N-(3-ethyl-7-bicyclo[4.1.0]hept-3-enyl)methanimine
CID 123511738
N-[6-[2-[(1E)-1-(2-ethylcyclopropylidene)propan-2-yl]cyclopropyl]-3,4-dimethylhexan-2-yl]methanimine
CID 163808808

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine?
The IUPAC name of N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine (CID 163930533) is N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine.
What is the SMILES notation for N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine?
The canonical SMILES for N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine is C=NC1CC=C(C2CC2CCCC(=C)C2CC2)CC1.
What is the InChIKey of N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine?
The InChIKey is RIHMOVJCESCGDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N/c1-13(14-6-7-14)4-3-5-16-12-18(16)15-8-10-17(19-2)11-9-15/h8,14,16-18H,1-7,9-12H2.
What are the key properties of N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine?
N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine has a molecular weight of 257.42 g/mol, XLogP of 4.94, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-cyclopropylpent-4-enyl)cyclopropyl]cyclohex-3-en-1-yl]methanimine is sourced from PubChem (CID 163930533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).