N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine

C15H15N2O3- — CID 21142512

IUPACN-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine
SMILESCOc1ccc2[nH]c3c(C)cc(N([O-])O)c(C)c3c2c1
InChIInChI=1S/C15H15N2O3/c1-8-6-13(17(18)19)9(2)14-11-7-10(20-3)4-5-12(11)16-15(8)14/h4-7,16,18H,1-3H3/q-1
InChIKeyIMAKKFKWOJHVNC-UHFFFAOYSA-N
MW271.30 g/mol
LogP3.64
Rot. Bonds2

About N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine

N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine (PubChem CID 21142512) has the molecular formula C15H15N2O3- and a molecular weight of 271.30 g/mol. Its IUPAC name is N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine.

Molecular Properties

Compound NameN-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine
PubChem CID21142512
Molecular FormulaC15H15N2O3-
Molecular Weight271.30 g/mol
Exact Mass271.11
IUPAC NameN-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine
SMILESCOc1ccc2[nH]c3c(C)cc(N([O-])O)c(C)c3c2c1
InChIInChI=1S/C15H15N2O3/c1-8-6-13(17(18)19)9(2)14-11-7-10(20-3)4-5-12(11)16-15(8)14/h4-7,16,18H,1-3H3/q-1
InChIKeyIMAKKFKWOJHVNC-UHFFFAOYSA-N
XLogP3.64
TPSA71.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide
CID 21142511
3-(1H-benzimidazol-2-yl)-6-methoxy-1,4-dimethyl-9H-carbazole
CID 168554394
1,9-dimethoxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazole
CID 14476701
methyl 6-methoxy-3-methyl-9H-carbazole-4-carboxylate
CID 86129099
5-methoxy-2-methyl-1H-indole-3-carboxylate
CID 6919949
N-[2-(6-methoxy-1-methyl-9H-carbazol-2-yl)ethyl]-N-methylacetamide
CID 3022622
3-chloro-8-methoxy-11,12-dihydroindolo[2,3-a]carbazole
CID 10758096
1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
CID 604823
6-methoxy-3-methyl-9H-carbazol-2-ol
CID 10353687
(5,8-dimethyl-6-nitro-9H-carbazol-3-yl) ethyl carbonate
CID 14662737
6-methoxy-4-methyl-1H-quinoline-2-thione
CID 935963
7,19-dimethoxy-13-methyl-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17(22),18,20-nonaene-12,14-dione
CID 21216832

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine?
The IUPAC name of N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine (CID 21142512) is N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine.
What is the SMILES notation for N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine?
The canonical SMILES for N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine is COc1ccc2[nH]c3c(C)cc(N([O-])O)c(C)c3c2c1.
What is the InChIKey of N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine?
The InChIKey is IMAKKFKWOJHVNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N2O3/c1-8-6-13(17(18)19)9(2)14-11-7-10(20-3)4-5-12(11)16-15(8)14/h4-7,16,18H,1-3H3/q-1.
What are the key properties of N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine?
N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine has a molecular weight of 271.30 g/mol, XLogP of 3.64, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine is sourced from PubChem (CID 21142512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).