N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine

C19H28N2 — CID 6396320

IUPACN-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine
SMILESC1=CC(/C=N/C2CCCCC2)C(/C=N/C2CCCCC2)=C1
InChIInChI=1S/C19H28N2/c1-3-10-18(11-4-1)20-14-16-8-7-9-17(16)15-21-19-12-5-2-6-13-19/h7-9,14-16,18-19H,1-6,10-13H2/b20-14+,21-15+
InChIKeyYMDRRKFUKALJIV-OZNQKUEASA-N
MW284.45 g/mol
LogP4.91
Rot. Bonds4

About N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine

N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine (PubChem CID 6396320) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine.

Molecular Properties

Compound NameN-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine
PubChem CID6396320
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC NameN-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine
SMILESC1=CC(/C=N/C2CCCCC2)C(/C=N/C2CCCCC2)=C1
InChIInChI=1S/C19H28N2/c1-3-10-18(11-4-1)20-14-16-8-7-9-17(16)15-21-19-12-5-2-6-13-19/h7-9,14-16,18-19H,1-6,10-13H2/b20-14+,21-15+
InChIKeyYMDRRKFUKALJIV-OZNQKUEASA-N
XLogP4.91
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-1-cyclopenta-1,3-dien-1-ylmethanimine
CID 18293350
N-(2-cyclohexa-1,3-dien-1-ylethyl)-1-[4-(2-cyclohexa-1,5-dien-1-ylethyliminomethyl)cyclopenta-1,3-dien-1-yl]methanimine
CID 130370022
ethane;3-[[2-[(E)-2-(4-methylcyclopenta-1,3-dien-1-yl)ethenyl]-2H-pyrrol-5-yl]methyl]-2,3-dihydropyridine
CID 142259552
chloroplatinum(1+);N-cyclohexyl-1-[3-(cyclohexyliminomethyl)benzene-2-id-1-yl]methanimine
CID 11455281
chloroplatinum(1+);N-cyclohexyl-1-[3-(cyclohexyliminomethyl)benzene-2-id-1-yl]methanimine
CID 54693396
1-[3-tert-butyl-5-(cyclohexyliminomethyl)benzene-6-id-1-yl]-N-cyclohexylmethanimine
CID 101770056
N-cyclohexyl-1-[3-(cyclohexyliminomethyl)benzene-2-id-1-yl]methanimine
CID 101770058
N-cyclohexyl-1-cyclopenta-2,4-dien-1-ylmethanimine
CID 102157468
3-[[2-[(E)-2-(4-methylcyclopenta-1,3-dien-1-yl)ethenyl]-2H-pyrrol-5-yl]methyl]-2,3-dihydropyridine
CID 142259553
cyclohexyl-[(Z)-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-ylidene]methyl]azanide
CID 177423880

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine?
The IUPAC name of N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine (CID 6396320) is N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine.
What is the SMILES notation for N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine?
The canonical SMILES for N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine is C1=CC(/C=N/C2CCCCC2)C(/C=N/C2CCCCC2)=C1.
What is the InChIKey of N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine?
The InChIKey is YMDRRKFUKALJIV-OZNQKUEASA-N. The full InChI is InChI=1S/C19H28N2/c1-3-10-18(11-4-1)20-14-16-8-7-9-17(16)15-21-19-12-5-2-6-13-19/h7-9,14-16,18-19H,1-6,10-13H2/b20-14+,21-15+.
What are the key properties of N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine?
N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine has a molecular weight of 284.45 g/mol, XLogP of 4.91, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-[2-(cyclohexyliminomethyl)cyclopenta-2,4-dien-1-yl]methanimine is sourced from PubChem (CID 6396320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).