6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole

C20H18N4 — CID 162755056

IUPAC6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole
SMILESCc1c2ccncc2cc2c3ccccc3n(CC3=NCCN3)c12
InChIInChI=1S/C20H18N4/c1-13-15-6-7-21-11-14(15)10-17-16-4-2-3-5-18(16)24(20(13)17)12-19-22-8-9-23-19/h2-7,10-11H,8-9,12H2,1H3,(H,22,23)
InChIKeyLAYRDYZITUGXRG-UHFFFAOYSA-N
MW314.39 g/mol
LogP3.65
Rot. Bonds2

About 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole

6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole (PubChem CID 162755056) has the molecular formula C20H18N4 and a molecular weight of 314.39 g/mol. Its IUPAC name is 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole.

Molecular Properties

Compound Name6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole
PubChem CID162755056
Molecular FormulaC20H18N4
Molecular Weight314.39 g/mol
Exact Mass314.15
IUPAC Name6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole
SMILESCc1c2ccncc2cc2c3ccccc3n(CC3=NCCN3)c12
InChIInChI=1S/C20H18N4/c1-13-15-6-7-21-11-14(15)10-17-16-4-2-3-5-18(16)24(20(13)17)12-19-22-8-9-23-19/h2-7,10-11H,8-9,12H2,1H3,(H,22,23)
InChIKeyLAYRDYZITUGXRG-UHFFFAOYSA-N
XLogP3.65
TPSA42.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

9-[2-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]-5,6-dimethylpyrido[4,3-b]carbazole
CID 162755280
9-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-7-fluoro-5,6-dimethylpyrido[4,3-b]carbazole
CID 162754982
9-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-5-methyl-[1]benzofuro[2,3-g]isoquinoline
CID 162754940
2-amino-9-(1,4,5,6-tetrahydropyrimidin-2-ylmethyl)pyrido[2,3-b]indole-3-carboxamide
CID 24900804
6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2,3,9-trimethylindolo[3,2-b]quinoxaline
CID 176729779
1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3-ethylindole;hydrochloride
CID 138398633
3-(5,6-dimethylpyrido[3,4-h]carbazol-7-yl)oxy-N,N-dimethylpropan-1-amine
CID 162755230
1-methyl-9-(pyridin-3-ylmethyl)pyrido[3,4-b]indole
CID 156780758
1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-N,N-dimethylindole-3-sulfonamide
CID 20756758
3-chloro-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-7-pyridin-3-ylindazole
CID 176780879
7-chloro-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3-pyridin-3-ylindazole
CID 176780882
5-chloro-1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3-methylsulfonylindol-2-amine
CID 141073307

Frequently Asked Questions

What is the IUPAC name of 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole?
The IUPAC name of 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole (CID 162755056) is 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole.
What is the SMILES notation for 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole?
The canonical SMILES for 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole is Cc1c2ccncc2cc2c3ccccc3n(CC3=NCCN3)c12.
What is the InChIKey of 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole?
The InChIKey is LAYRDYZITUGXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4/c1-13-15-6-7-21-11-14(15)10-17-16-4-2-3-5-18(16)24(20(13)17)12-19-22-8-9-23-19/h2-7,10-11H,8-9,12H2,1H3,(H,22,23).
What are the key properties of 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole?
6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole has a molecular weight of 314.39 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylpyrido[4,3-b]carbazole is sourced from PubChem (CID 162755056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).