1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine

C20H24N4 — CID 46193464

IUPAC1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine
SMILESC/C(=N\[C@@H]1CCCC[C@H]1/N=C(\C)c1ccccn1)c1ccccn1
InChIInChI=1S/C20H24N4/c1-15(17-9-5-7-13-21-17)23-19-11-3-4-12-20(19)24-16(2)18-10-6-8-14-22-18/h5-10,13-14,19-20H,3-4,11-12H2,1-2H3/b23-15+,24-16+/t19-,20-/m1/s1
InChIKeyVQPCQHIWEFVZQG-XADFGDBWSA-N
MW320.44 g/mol
LogP4.11
Rot. Bonds4

About 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine

1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine (PubChem CID 46193464) has the molecular formula C20H24N4 and a molecular weight of 320.44 g/mol. Its IUPAC name is 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine.

Molecular Properties

Compound Name1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine
PubChem CID46193464
Molecular FormulaC20H24N4
Molecular Weight320.44 g/mol
Exact Mass320.20
IUPAC Name1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine
SMILESC/C(=N\[C@@H]1CCCC[C@H]1/N=C(\C)c1ccccn1)c1ccccn1
InChIInChI=1S/C20H24N4/c1-15(17-9-5-7-13-21-17)23-19-11-3-4-12-20(19)24-16(2)18-10-6-8-14-22-18/h5-10,13-14,19-20H,3-4,11-12H2,1-2H3/b23-15+,24-16+/t19-,20-/m1/s1
InChIKeyVQPCQHIWEFVZQG-XADFGDBWSA-N
XLogP4.11
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine with MolForge

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Related Compounds

N'-[(1R,2S)-2-aminocyclohexyl]pyridine-2-carboximidamide
CID 141171562
N-methyl-1-pyridin-2-ylethanimine
CID 12970828
[(E)-1-pyridin-2-ylethylideneamino]methanol
CID 121226769
1-pyridin-2-yl-N-[3-(1-pyridin-2-ylethylideneamino)propyl]ethanimine
CID 14907728
N-methoxy-1-pyridin-2-ylethanimine
CID 87078601
N-[2,2-dimethyl-3-(1-pyridin-2-ylethylideneamino)propyl]-1-pyridin-2-ylethanimine
CID 102087049
palladium(2+);bis(2-(1-pyridin-2-ylethylideneamino)benzenethiolate)
CID 10650522
N-butyl-1-pyridin-2-ylethanimine
CID 583773
2-methyl-N-[(Z)-1-pyridin-2-ylethylideneamino]piperidine-1-carbothioamide
CID 90674793
N-amino-N'-cycloheptylpyridine-2-carboximidamide
CID 61361948
CID 152756166
CID 152756166
[(cyclopentylamino)-sulfoniumylidenemethyl]-(1-pyridin-2-ylethylideneamino)azanide;dichlorocopper
CID 135469415

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine?
The IUPAC name of 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine (CID 46193464) is 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine.
What is the SMILES notation for 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine?
The canonical SMILES for 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine is C/C(=N\[C@@H]1CCCC[C@H]1/N=C(\C)c1ccccn1)c1ccccn1.
What is the InChIKey of 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine?
The InChIKey is VQPCQHIWEFVZQG-XADFGDBWSA-N. The full InChI is InChI=1S/C20H24N4/c1-15(17-9-5-7-13-21-17)23-19-11-3-4-12-20(19)24-16(2)18-10-6-8-14-22-18/h5-10,13-14,19-20H,3-4,11-12H2,1-2H3/b23-15+,24-16+/t19-,20-/m1/s1.
What are the key properties of 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine?
1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine has a molecular weight of 320.44 g/mol, XLogP of 4.11, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-2-yl-N-[(1R,2R)-2-(1-pyridin-2-ylethylideneamino)cyclohexyl]ethanimine is sourced from PubChem (CID 46193464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).