7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde

C18H18N2O — CID 87357357

IUPAC7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde
SMILESO=Cc1ncn2c1CCc1cc(C3=CCCCC3)ccc1-2
InChIInChI=1S/C18H18N2O/c21-11-16-18-9-7-15-10-14(13-4-2-1-3-5-13)6-8-17(15)20(18)12-19-16/h4,6,8,10-12H,1-3,5,7,9H2
InChIKeyBBWBQBGAXKOVHR-UHFFFAOYSA-N
MW278.35 g/mol
LogP3.74
Rot. Bonds2

About 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde

7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde (PubChem CID 87357357) has the molecular formula C18H18N2O and a molecular weight of 278.35 g/mol. Its IUPAC name is 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde.

Molecular Properties

Compound Name7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde
PubChem CID87357357
Molecular FormulaC18H18N2O
Molecular Weight278.35 g/mol
Exact Mass278.14
IUPAC Name7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde
SMILESO=Cc1ncn2c1CCc1cc(C3=CCCCC3)ccc1-2
InChIInChI=1S/C18H18N2O/c21-11-16-18-9-7-15-10-14(13-4-2-1-3-5-13)6-8-17(15)20(18)12-19-16/h4,6,8,10-12H,1-3,5,7,9H2
InChIKeyBBWBQBGAXKOVHR-UHFFFAOYSA-N
XLogP3.74
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-(cyclohexen-1-yl)-1,2,3,4-tetrahydronaphthalene
CID 20500285
5-(cyclohexen-1-yl)-2,3-dihydro-1H-indene
CID 123334051
6-(cyclohexen-1-yl)-3-methyl-1,3-benzoxazol-2-one
CID 167568895
(1S)-1-(7-methyl-4,5-dihydroimidazo[1,5-a]quinolin-3-yl)ethanamine
CID 153219508
1-methyl-6-(2,3,6,7-tetrahydro-1H-azepin-4-yl)-3,4-dihydroquinolin-2-one
CID 82299704
1-(4-phenylphenyl)cycloheptene
CID 58982123
[4-(cyclohexen-1-yl)phenoxy]methylsilane
CID 160586501
(1E)-1-[(1E)-cyclopentadecen-1-yl]cyclopentadecene
CID 139760940
1-(cyclodecen-1-yl)cyclodecene
CID 54296371
4-(2,3-dihydro-1H-inden-5-yl)benzaldehyde
CID 54910359
[4-[(1E)-cycloocten-1-yl]phenyl]-phenylmethanone
CID 101228026
7-(cyclohexen-1-yl)-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridine
CID 174194024

Frequently Asked Questions

What is the IUPAC name of 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde?
The IUPAC name of 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde (CID 87357357) is 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde.
What is the SMILES notation for 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde?
The canonical SMILES for 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde is O=Cc1ncn2c1CCc1cc(C3=CCCCC3)ccc1-2.
What is the InChIKey of 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde?
The InChIKey is BBWBQBGAXKOVHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c21-11-16-18-9-7-15-10-14(13-4-2-1-3-5-13)6-8-17(15)20(18)12-19-16/h4,6,8,10-12H,1-3,5,7,9H2.
What are the key properties of 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde?
7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde has a molecular weight of 278.35 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclohexen-1-yl)-4,5-dihydroimidazo[1,5-a]quinoline-3-carbaldehyde is sourced from PubChem (CID 87357357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).