1-(1H-indol-6-yl)-N-methoxymethanamine

C10H12N2O — CID 82599129

IUPAC1-(1H-indol-6-yl)-N-methoxymethanamine
SMILESCONCc1ccc2cc[nH]c2c1
InChIInChI=1S/C10H12N2O/c1-13-12-7-8-2-3-9-4-5-11-10(9)6-8/h2-6,11-12H,7H2,1H3
InChIKeyZKZVFECCHVQZCW-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.82
Rot. Bonds3

About 1-(1H-indol-6-yl)-N-methoxymethanamine

1-(1H-indol-6-yl)-N-methoxymethanamine (PubChem CID 82599129) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 1-(1H-indol-6-yl)-N-methoxymethanamine.

Molecular Properties

Compound Name1-(1H-indol-6-yl)-N-methoxymethanamine
PubChem CID82599129
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name1-(1H-indol-6-yl)-N-methoxymethanamine
SMILESCONCc1ccc2cc[nH]c2c1
InChIInChI=1S/C10H12N2O/c1-13-12-7-8-2-3-9-4-5-11-10(9)6-8/h2-6,11-12H,7H2,1H3
InChIKeyZKZVFECCHVQZCW-UHFFFAOYSA-N
XLogP1.82
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(1H-indol-6-ylmethyl)-1-methoxy-2-methylpropan-2-amine
CID 102911940
N-(1H-indol-6-ylmethyl)-2-(4-methoxyphenyl)ethanamine
CID 53274315
N-(1H-indol-6-ylmethyl)but-2-yn-1-amine
CID 102911908
N-(1H-indol-6-ylmethyl)butan-1-amine
CID 63749151
N-(1H-indol-6-ylmethyl)-1-(4-methoxyphenyl)ethanamine
CID 102911336
1-(1H-indol-6-yl)-N-(oxan-2-yloxy)methanamine
CID 170703836
N-(1H-indol-6-ylmethyl)aniline
CID 29012556
1-(4-ethylcyclohexyl)-N-(1H-indol-6-ylmethyl)methanamine
CID 102910232
N-(1H-indol-6-ylmethyl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 102909156
N-[(4-fluoro-3,5-dimethylphenyl)methyl]-1-(1H-indol-6-yl)methanamine
CID 102911465
6-(bromomethyl)-1H-indole
CID 22062878
1-(3-ethoxyphenyl)-N-(1H-indol-6-ylmethyl)methanamine
CID 102909966

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-6-yl)-N-methoxymethanamine?
The IUPAC name of 1-(1H-indol-6-yl)-N-methoxymethanamine (CID 82599129) is 1-(1H-indol-6-yl)-N-methoxymethanamine.
What is the SMILES notation for 1-(1H-indol-6-yl)-N-methoxymethanamine?
The canonical SMILES for 1-(1H-indol-6-yl)-N-methoxymethanamine is CONCc1ccc2cc[nH]c2c1.
What is the InChIKey of 1-(1H-indol-6-yl)-N-methoxymethanamine?
The InChIKey is ZKZVFECCHVQZCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-13-12-7-8-2-3-9-4-5-11-10(9)6-8/h2-6,11-12H,7H2,1H3.
What are the key properties of 1-(1H-indol-6-yl)-N-methoxymethanamine?
1-(1H-indol-6-yl)-N-methoxymethanamine has a molecular weight of 176.22 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-6-yl)-N-methoxymethanamine is sourced from PubChem (CID 82599129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).