9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole

C21H18N4O — CID 162754818

IUPAC9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole
SMILESCc1c2ccncc2cc2c3cc(OCc4ncc[nH]4)ccc3n(C)c12
InChIInChI=1S/C21H18N4O/c1-13-16-5-6-22-11-14(16)9-18-17-10-15(26-12-20-23-7-8-24-20)3-4-19(17)25(2)21(13)18/h3-11H,12H2,1-2H3,(H,23,24)
InChIKeyKJOSMVCPKXUWSS-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.49
Rot. Bonds3

About 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole

9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole (PubChem CID 162754818) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole.

Molecular Properties

Compound Name9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole
PubChem CID162754818
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC Name9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole
SMILESCc1c2ccncc2cc2c3cc(OCc4ncc[nH]4)ccc3n(C)c12
InChIInChI=1S/C21H18N4O/c1-13-16-5-6-22-11-14(16)9-18-17-10-15(26-12-20-23-7-8-24-20)3-4-19(17)25(2)21(13)18/h3-11H,12H2,1-2H3,(H,23,24)
InChIKeyKJOSMVCPKXUWSS-UHFFFAOYSA-N
XLogP4.49
TPSA55.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5,6-dimethyl-9-pyridin-4-yloxypyrido[4,3-b]carbazole
CID 162755227
(2S)-1-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxy-N-methylpropan-2-amine
CID 162754821
9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole
CID 162755280
9-[2-(azepan-1-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole
CID 162754930
4-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxypyridin-2-amine
CID 162755193
N-(2,2-difluoroethyl)-1-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxypropan-2-amine
CID 166986452
N-[2-(dimethylamino)ethyl]-2-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxyacetamide
CID 162755000
2-[1-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxypropan-2-yl]isoindole-1,3-dione
CID 166986426
2-[(2S)-1-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxypropan-2-yl]isoindole-1,3-dione
CID 162755196
2-(10,11-dimethylpyrido[3,4-b]carbazol-7-yl)oxyethanimidamide
CID 162755037
4-[2-(5,6-dimethylpyrido[4,3-b]carbazol-8-yl)oxyethyl]morpholine
CID 162755206
9-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-7-fluoro-5,6-dimethylpyrido[4,3-b]carbazole
CID 162754982

Frequently Asked Questions

What is the IUPAC name of 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole?
The IUPAC name of 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole (CID 162754818) is 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole.
What is the SMILES notation for 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole?
The canonical SMILES for 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole is Cc1c2ccncc2cc2c3cc(OCc4ncc[nH]4)ccc3n(C)c12.
What is the InChIKey of 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole?
The InChIKey is KJOSMVCPKXUWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-13-16-5-6-22-11-14(16)9-18-17-10-15(26-12-20-23-7-8-24-20)3-4-19(17)25(2)21(13)18/h3-11H,12H2,1-2H3,(H,23,24).
What are the key properties of 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole?
9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole has a molecular weight of 342.40 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole is sourced from PubChem (CID 162754818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).