O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine

C10H11ClN2O — CID 117300853

IUPACO-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine
SMILESCn1cc(Cl)c2cccc(CON)c21
InChIInChI=1S/C10H11ClN2O/c1-13-5-9(11)8-4-2-3-7(6-14-12)10(8)13/h2-5H,6,12H2,1H3
InChIKeyOTMNPYSDTFEAEN-UHFFFAOYSA-N
MW210.66 g/mol
LogP2.22
Rot. Bonds2

About O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine

O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine (PubChem CID 117300853) has the molecular formula C10H11ClN2O and a molecular weight of 210.66 g/mol. Its IUPAC name is O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine
PubChem CID117300853
Molecular FormulaC10H11ClN2O
Molecular Weight210.66 g/mol
Exact Mass210.06
IUPAC NameO-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine
SMILESCn1cc(Cl)c2cccc(CON)c21
InChIInChI=1S/C10H11ClN2O/c1-13-5-9(11)8-4-2-3-7(6-14-12)10(8)13/h2-5H,6,12H2,1H3
InChIKeyOTMNPYSDTFEAEN-UHFFFAOYSA-N
XLogP2.22
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine 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

3-(3-chloro-1-methylindol-7-yl)propan-1-ol
CID 117321059
O-[(7-chloro-1-propan-2-ylindol-3-yl)methyl]hydroxylamine
CID 117197683
1-[(3-chloro-1-methylindol-7-yl)methyl]cyclopropan-1-ol
CID 117343953
3-chloro-1-methyl-7-(2-piperazin-1-ylethyl)indole
CID 117445345
[3-(ethoxymethyl)-1-methylindol-7-yl]methanamine
CID 117181731
O-[2-(3-chloro-1-methylindol-4-yl)ethyl]hydroxylamine
CID 117322623
3-(aminooxymethyl)-1-propan-2-ylindol-7-ol
CID 117197927
2-(aminooxymethyl)-6-chlorophenol
CID 117277054
O-[(2-chloro-3-methylphenyl)methyl]hydroxylamine
CID 117276900
O-[(6-chloro-1-methylindol-3-yl)methyl]hydroxylamine
CID 117196287
O-[(7-chloro-1-benzofuran-3-yl)methyl]hydroxylamine
CID 117197472
5-(3-chloro-1-methylindol-7-yl)-1H-pyrazol-3-amine
CID 117369289

Frequently Asked Questions

What is the IUPAC name of O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine?
The IUPAC name of O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine (CID 117300853) is O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine.
What is the SMILES notation for O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine?
The canonical SMILES for O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine is Cn1cc(Cl)c2cccc(CON)c21.
What is the InChIKey of O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine?
The InChIKey is OTMNPYSDTFEAEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O/c1-13-5-9(11)8-4-2-3-7(6-14-12)10(8)13/h2-5H,6,12H2,1H3.
What are the key properties of O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine?
O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine has a molecular weight of 210.66 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine is sourced from PubChem (CID 117300853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).