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

C22H22N4O — CID 162755280

IUPAC9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole
SMILESCc1c2ccncc2cc2c3cc(OCCC4=NCCN4)ccc3n(C)c12
InChIInChI=1S/C22H22N4O/c1-14-17-5-7-23-13-15(17)11-19-18-12-16(3-4-20(18)26(2)22(14)19)27-10-6-21-24-8-9-25-21/h3-5,7,11-13H,6,8-10H2,1-2H3,(H,24,25)
InChIKeyPAWXWQFHROBJJF-UHFFFAOYSA-N
MW358.45 g/mol
LogP3.96
Rot. Bonds4

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

9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole (PubChem CID 162755280) has the molecular formula C22H22N4O and a molecular weight of 358.45 g/mol. Its IUPAC name is 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole.

Molecular Properties

Compound Name9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole
PubChem CID162755280
Molecular FormulaC22H22N4O
Molecular Weight358.45 g/mol
Exact Mass358.18
IUPAC Name9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole
SMILESCc1c2ccncc2cc2c3cc(OCCC4=NCCN4)ccc3n(C)c12
InChIInChI=1S/C22H22N4O/c1-14-17-5-7-23-13-15(17)11-19-18-12-16(3-4-20(18)26(2)22(14)19)27-10-6-21-24-8-9-25-21/h3-5,7,11-13H,6,8-10H2,1-2H3,(H,24,25)
InChIKeyPAWXWQFHROBJJF-UHFFFAOYSA-N
XLogP3.96
TPSA51.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.45
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

9-[2-(azepan-1-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole
CID 162754930
9-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-7-fluoro-5,6-dimethylpyrido[4,3-b]carbazole
CID 162754982
9-(1H-imidazol-2-ylmethoxy)-5,6-dimethylpyrido[4,3-b]carbazole
CID 162754818
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
N-[2-(dimethylamino)ethyl]-2-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxyacetamide
CID 162755000
4-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxypyridin-2-amine
CID 162755193
4-[2-(5,6-dimethylpyrido[4,3-b]carbazol-8-yl)oxyethyl]morpholine
CID 162755206
6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole
CID 162755056
N-(2,2-difluoroethyl)-1-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxypropan-2-amine
CID 166986452
9-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-5-methyl-[1]benzofuro[2,3-g]isoquinoline
CID 162754940
2-[1-(5,6-dimethylpyrido[4,3-b]carbazol-9-yl)oxypropan-2-yl]isoindole-1,3-dione
CID 166986426

Frequently Asked Questions

What is the IUPAC name of 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole?
The IUPAC name of 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole (CID 162755280) is 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole.
What is the SMILES notation for 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole?
The canonical SMILES for 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole is Cc1c2ccncc2cc2c3cc(OCCC4=NCCN4)ccc3n(C)c12.
What is the InChIKey of 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole?
The InChIKey is PAWXWQFHROBJJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O/c1-14-17-5-7-23-13-15(17)11-19-18-12-16(3-4-20(18)26(2)22(14)19)27-10-6-21-24-8-9-25-21/h3-5,7,11-13H,6,8-10H2,1-2H3,(H,24,25).
What are the key properties of 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole?
9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole has a molecular weight of 358.45 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole is sourced from PubChem (CID 162755280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).