1-(methoxymethyl)indol-6-amine

C10H12N2O — CID 65365107

IUPAC1-(methoxymethyl)indol-6-amine
SMILESCOCn1ccc2ccc(N)cc21
InChIInChI=1S/C10H12N2O/c1-13-7-12-5-4-8-2-3-9(11)6-10(8)12/h2-6H,7,11H2,1H3
InChIKeyOVVVVBNYRUKGMC-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.83
Rot. Bonds2

About 1-(methoxymethyl)indol-6-amine

1-(methoxymethyl)indol-6-amine (PubChem CID 65365107) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 1-(methoxymethyl)indol-6-amine.

Molecular Properties

Compound Name1-(methoxymethyl)indol-6-amine
PubChem CID65365107
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name1-(methoxymethyl)indol-6-amine
SMILESCOCn1ccc2ccc(N)cc21
InChIInChI=1S/C10H12N2O/c1-13-7-12-5-4-8-2-3-9(11)6-10(8)12/h2-6H,7,11H2,1H3
InChIKeyOVVVVBNYRUKGMC-UHFFFAOYSA-N
XLogP1.83
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-(3-methoxypropyl)indol-6-amine
CID 58005499
1-benzylindol-6-amine
CID 69325204
1-[(3-fluoro-4-methoxyphenyl)methyl]indol-6-amine
CID 43308823
1-(methoxymethyl)-5-methylindole
CID 110831319
1-but-3-enylindol-6-amine
CID 165471845
1-(cyclobutylmethyl)indol-6-amine
CID 65457807
[4-[(6-aminoindol-1-yl)methyl]phenyl]methanol;hydrochloride
CID 126796353
1-[(2-chloro-4-methylphenyl)methyl]indol-6-amine
CID 106863378
1-ethylindol-6-amine;1-ethyl-6-nitroindole
CID 159386864
1-(thiophen-2-ylmethyl)indol-6-amine
CID 43308863
1-[(2-fluorophenyl)methyl]indol-6-amine
CID 43308904
9-(methoxymethyl)carbazole-3,6-diamine
CID 174533461

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)indol-6-amine?
The IUPAC name of 1-(methoxymethyl)indol-6-amine (CID 65365107) is 1-(methoxymethyl)indol-6-amine.
What is the SMILES notation for 1-(methoxymethyl)indol-6-amine?
The canonical SMILES for 1-(methoxymethyl)indol-6-amine is COCn1ccc2ccc(N)cc21.
What is the InChIKey of 1-(methoxymethyl)indol-6-amine?
The InChIKey is OVVVVBNYRUKGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-13-7-12-5-4-8-2-3-9(11)6-10(8)12/h2-6H,7,11H2,1H3.
What are the key properties of 1-(methoxymethyl)indol-6-amine?
1-(methoxymethyl)indol-6-amine has a molecular weight of 176.22 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)indol-6-amine is sourced from PubChem (CID 65365107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).