N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide

C15H16N2O3 — CID 21142511

IUPACN-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide
SMILESCOc1ccc2[nH]c3c(C)cc([NH+]([O-])O)c(C)c3c2c1
InChIInChI=1S/C15H16N2O3/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
InChIKeyRNEMGLSMLROZJU-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.35
Rot. Bonds2

About N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide

N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide (PubChem CID 21142511) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide.

Molecular Properties

Compound NameN-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide
PubChem CID21142511
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide
SMILESCOc1ccc2[nH]c3c(C)cc([NH+]([O-])O)c(C)c3c2c1
InChIInChI=1S/C15H16N2O3/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
InChIKeyRNEMGLSMLROZJU-UHFFFAOYSA-N
XLogP2.35
TPSA72.75 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-methoxy-1,4-dimethyl-9H-carbazol-3-yl)-N-oxidohydroxylamine
CID 21142512
N-hydroxy-4-methoxy-2-methylbenzeneamine oxide
CID 163166286
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
6-methoxy-4-methyl-1H-quinoline-2-thione
CID 935963
7-methoxy-3,15-diazahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4(9),5,7,11,14(22),16,18,20,23-undecaene
CID 24774105
5-methoxy-2-methyl-1H-indole-3-carboxylate
CID 6919949
N-[2-(6-methoxy-1-methyl-9H-carbazol-2-yl)ethyl]-2-oxobutanamide
CID 18982851
3-chloro-8-methoxy-11,12-dihydroindolo[2,3-a]carbazole
CID 10758096
6-methoxy-3-methyl-9H-carbazol-2-ol
CID 10353687
1-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
CID 604823

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide?
The IUPAC name of N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide (CID 21142511) is N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide.
What is the SMILES notation for N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide?
The canonical SMILES for N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide is COc1ccc2[nH]c3c(C)cc([NH+]([O-])O)c(C)c3c2c1.
What is the InChIKey of N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide?
The InChIKey is RNEMGLSMLROZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/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.
What are the key properties of N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide?
N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide has a molecular weight of 272.30 g/mol, XLogP of 2.35, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-6-methoxy-1,4-dimethyl-9H-carbazol-3-amine oxide is sourced from PubChem (CID 21142511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).