N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine

C23H26N2 — CID 148568027

IUPACN-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine
SMILESc1ccc(C2(/N=C3\Nc4ccccc4CC34CCCCC4)CC2)cc1
InChIInChI=1S/C23H26N2/c1-3-10-19(11-4-1)23(15-16-23)25-21-22(13-7-2-8-14-22)17-18-9-5-6-12-20(18)24-21/h1,3-6,9-12H,2,7-8,13-17H2,(H,24,25)
InChIKeyMWHYQMAAQYQQKS-UHFFFAOYSA-N
MW330.47 g/mol
LogP5.69
Rot. Bonds2

About N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine

N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine (PubChem CID 148568027) has the molecular formula C23H26N2 and a molecular weight of 330.47 g/mol. Its IUPAC name is N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine.

Molecular Properties

Compound NameN-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine
PubChem CID148568027
Molecular FormulaC23H26N2
Molecular Weight330.47 g/mol
Exact Mass330.21
IUPAC NameN-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine
SMILESc1ccc(C2(/N=C3\Nc4ccccc4CC34CCCCC4)CC2)cc1
InChIInChI=1S/C23H26N2/c1-3-10-19(11-4-1)23(15-16-23)25-21-22(13-7-2-8-14-22)17-18-9-5-6-12-20(18)24-21/h1,3-6,9-12H,2,7-8,13-17H2,(H,24,25)
InChIKeyMWHYQMAAQYQQKS-UHFFFAOYSA-N
XLogP5.69
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.47
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-[(spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-ylideneamino)methyl]benzonitrile
CID 159775333
N-[(2,3-dichlorophenyl)methyl]spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine
CID 160811986
spiro[2,4-dihydro-1H-isoquinoline-3,1'-cycloheptane]
CID 141049949
N-(1-phenylethyl)spiro[1,4-dihydroquinoline-3,4'-piperidine]-2-imine
CID 159248930
N-[(3-chlorophenyl)methyl]-1'-methylspiro[1,4-dihydroquinoline-3,3'-azepane]-2-imine
CID 162087932
N-[(2-chlorophenyl)methyl]-1'-methylspiro[1,4-dihydroquinoline-3,4'-piperidine]-2-imine
CID 148619189
N-benzylspiro[5,8-dihydropyrido[3,2-d]pyrimidine-7,1'-cyclohexane]-6-imine
CID 147154425
N-[(2-phenoxyphenyl)methyl]spiro[1,4-dihydroquinoline-3,4'-oxane]-2-imine
CID 149046567
N-benzylspiro[1,4-dihydroquinoline-3,3'-8-azabicyclo[3.2.1]octane]-2-imine
CID 158769067
N-[[4-(trifluoromethyl)phenyl]methyl]spiro[1,4-dihydroquinoline-3,4'-piperidine]-2-imine
CID 146922887
N-[1-(2-chlorophenyl)ethyl]spiro[1,4-dihydroquinoline-3,4'-thiane]-2-imine
CID 153198108
1,1-diphenylcyclotetradecane
CID 175822005

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine?
The IUPAC name of N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine (CID 148568027) is N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine.
What is the SMILES notation for N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine?
The canonical SMILES for N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine is c1ccc(C2(/N=C3\Nc4ccccc4CC34CCCCC4)CC2)cc1.
What is the InChIKey of N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine?
The InChIKey is MWHYQMAAQYQQKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2/c1-3-10-19(11-4-1)23(15-16-23)25-21-22(13-7-2-8-14-22)17-18-9-5-6-12-20(18)24-21/h1,3-6,9-12H,2,7-8,13-17H2,(H,24,25).
What are the key properties of N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine?
N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine has a molecular weight of 330.47 g/mol, XLogP of 5.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylcyclopropyl)spiro[1,4-dihydroquinoline-3,1'-cyclohexane]-2-imine is sourced from PubChem (CID 148568027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).