9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole

C34H25N5O — CID 158969256

IUPAC9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole
SMILESc1ccc2c(c1)Nc1ccccc1O2.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)[nH]c1nccnc12
InChIInChI=1S/C12H9NO.C12H9N.C10H7N3/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-8-7(3-1)9-10(13-8)12-6-5-11-9/h1-8,13H;1-8,13H;1-6H,(H,12,13)
InChIKeyJNPBMFXKZMVPLR-UHFFFAOYSA-N
MW519.61 g/mol
LogP8.97
Rot. Bonds

About 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole

9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole (PubChem CID 158969256) has the molecular formula C34H25N5O and a molecular weight of 519.61 g/mol. Its IUPAC name is 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole.

Molecular Properties

Compound Name9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole
PubChem CID158969256
Molecular FormulaC34H25N5O
Molecular Weight519.61 g/mol
Exact Mass519.21
IUPAC Name9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole
SMILESc1ccc2c(c1)Nc1ccccc1O2.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)[nH]c1nccnc12
InChIInChI=1S/C12H9NO.C12H9N.C10H7N3/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-8-7(3-1)9-10(13-8)12-6-5-11-9/h1-8,13H;1-8,13H;1-6H,(H,12,13)
InChIKeyJNPBMFXKZMVPLR-UHFFFAOYSA-N
XLogP8.97
TPSA78.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500519.61
LogP ≤ 58.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N4-methyl-N2-{2-methyl-1-[2-({3-methyl-3H-imidazo[4,5-b]pyridin-6-yl}oxy)phenyl]-1H-indol-6-yl}pyrimidine-2,4-diamine
CID 121231410
N2-(4-(4-isopropylpiperazin-1-yl)-2-methoxyphenyl)-N4-(quinolin-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
CID 44581765
3-(3-Phenoxybenzyl)amino-|A-carboline
CID 56666556
[2-(1H-Benzoimidazol-4-yloxy)-ethyl]-[3-(1H-indol-3-yl)-propyl]-amine
CID 11232913
2-(7-(2-Methoxyethoxy)imidazo[1,2-a]pyridin-3-yl)-8-(pyrrolidin-3-ylmethoxy)quinoline
CID 25098432
1-(3-{5-[4-(Aminomethyl)phenyl]-1h-Pyrrolo[2,3-B]pyridin-3-Yl}phenyl)-3-(2-Phenoxyphenyl)urea
CID 25920884
N~4~-Methyl-N~2~-[2-Methyl-1-(2-Phenoxyphenyl)-1h-Indol-6-Yl]pyrimidine-2,4-Diamine
CID 121005806
4-N-(4-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3-yl}phenyl)pyrimidine-2,4-diamine
CID 10238471
4-[4-(4-methoxyphenyl)piperazino]-5H-pyrimido[5,4-b]indole
CID 1475855
8-(1H-benzimidazol-2-ylmethoxy)quinoline
CID 2231560
(3S)-1-(4-methoxyphenyl)-3-(5-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
CID 9802240
N-[(R)-2-(1H-Indol-3-yl)-1-(4-phenyl-1H-imidazol-2-yl)-ethyl]-4-methoxy-benzamidine
CID 10094509

Frequently Asked Questions

What is the IUPAC name of 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole?
The IUPAC name of 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole (CID 158969256) is 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole.
What is the SMILES notation for 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole?
The canonical SMILES for 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole is c1ccc2c(c1)Nc1ccccc1O2.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)[nH]c1nccnc12.
What is the InChIKey of 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole?
The InChIKey is JNPBMFXKZMVPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO.C12H9N.C10H7N3/c1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-8-7(3-1)9-10(13-8)12-6-5-11-9/h1-8,13H;1-8,13H;1-6H,(H,12,13).
What are the key properties of 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole?
9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole has a molecular weight of 519.61 g/mol, XLogP of 8.97, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole;10H-phenoxazine;5H-pyrazino[2,3-b]indole is sourced from PubChem (CID 158969256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).