2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline

C26H26N2O — CID 177401358

IUPAC2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline
SMILESCOc1cccc2c1nc(C)c1cc(C3=CCCCC3)n(-c3ccccc3C)c12
InChIInChI=1S/C26H26N2O/c1-17-10-7-8-14-22(17)28-23(19-11-5-4-6-12-19)16-21-18(2)27-25-20(26(21)28)13-9-15-24(25)29-3/h7-11,13-16H,4-6,12H2,1-3H3
InChIKeyLZKSZUPRMDUYCP-UHFFFAOYSA-N
MW382.51 g/mol
LogP6.76
Rot. Bonds3

About 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline

2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline (PubChem CID 177401358) has the molecular formula C26H26N2O and a molecular weight of 382.51 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline
PubChem CID177401358
Molecular FormulaC26H26N2O
Molecular Weight382.51 g/mol
Exact Mass382.20
IUPAC Name2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline
SMILESCOc1cccc2c1nc(C)c1cc(C3=CCCCC3)n(-c3ccccc3C)c12
InChIInChI=1S/C26H26N2O/c1-17-10-7-8-14-22(17)28-23(19-11-5-4-6-12-19)16-21-18(2)27-25-20(26(21)28)13-9-15-24(25)29-3/h7-11,13-16H,4-6,12H2,1-3H3
InChIKeyLZKSZUPRMDUYCP-UHFFFAOYSA-N
XLogP6.76
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.51
LogP ≤ 56.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluoro-2-methylphenyl)-6-methoxy-4-methyl-2-phenylpyrrolo[3,2-c]quinoline
CID 142666155
[6-methoxy-1-(2-methylphenyl)-2-trimethylsilylpyrrolo[3,2-c]quinolin-3-yl]methanol
CID 100966751
2-chloro-8-methoxy-4-methylquinazoline
CID 59199295
1-(2-chlorophenyl)-6-methoxy-3,4-dimethylpyrazolo[4,3-c]quinoline
CID 110173752
8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione
CID 117261966
2-(cyclohexen-1-yl)-3-methoxyquinoline
CID 140669525
8-methoxy-4-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)quinoline
CID 23931520
1-(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)ethanamine
CID 82451910
6-methoxy-1-(4-methoxyphenyl)-4-methyl-2,3-dihydropyrrolo[3,2-c]quinoline
CID 3600945
trans-(1S,2S)-1-N,2-N-bis(8-methoxy-4-pyrrolidin-1-ylquinolin-2-yl)cyclohexane-1,2-diamine
CID 118548103
3-(cyclohexen-1-yl)-4-methoxyaniline
CID 141347740
(8-methoxy-4-methylquinazolin-2-yl)methanamine
CID 84777278

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline?
The IUPAC name of 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline (CID 177401358) is 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline.
What is the SMILES notation for 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline?
The canonical SMILES for 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline is COc1cccc2c1nc(C)c1cc(C3=CCCCC3)n(-c3ccccc3C)c12.
What is the InChIKey of 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline?
The InChIKey is LZKSZUPRMDUYCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O/c1-17-10-7-8-14-22(17)28-23(19-11-5-4-6-12-19)16-21-18(2)27-25-20(26(21)28)13-9-15-24(25)29-3/h7-11,13-16H,4-6,12H2,1-3H3.
What are the key properties of 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline?
2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline has a molecular weight of 382.51 g/mol, XLogP of 6.76, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)-6-methoxy-4-methyl-1-(2-methylphenyl)pyrrolo[3,2-c]quinoline is sourced from PubChem (CID 177401358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).