5-methoxy-1-methylpyrrol-3-amine

C6H10N2O — CID 69339573

IUPAC5-methoxy-1-methylpyrrol-3-amine
SMILESCOc1cc(N)cn1C
InChIInChI=1S/C6H10N2O/c1-8-4-5(7)3-6(8)9-2/h3-4H,7H2,1-2H3
InChIKeyMAVHMEQIZADABH-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.62
Rot. Bonds1

About 5-methoxy-1-methylpyrrol-3-amine

5-methoxy-1-methylpyrrol-3-amine (PubChem CID 69339573) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 5-methoxy-1-methylpyrrol-3-amine.

Molecular Properties

Compound Name5-methoxy-1-methylpyrrol-3-amine
PubChem CID69339573
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name5-methoxy-1-methylpyrrol-3-amine
SMILESCOc1cc(N)cn1C
InChIInChI=1S/C6H10N2O/c1-8-4-5(7)3-6(8)9-2/h3-4H,7H2,1-2H3
InChIKeyMAVHMEQIZADABH-UHFFFAOYSA-N
XLogP0.62
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-amino-1-methylpyrrol-2-yl) acetate
CID 174595112
2-(5-methoxy-1-methylpyrrol-3-yl)ethanamine
CID 54356902
4-methoxy-1-methylpyrrol-2-amine
CID 69332729
(4-amino-1-methylpyrrol-2-yl)methanol
CID 12532409
5-methoxy-1-methylpyrazol-3-amine
CID 55284551
5-amino-1,3-dimethylpyridin-2-one
CID 67456616
methoxymethyl 4-amino-1-methylpyrrole-2-carboxylate
CID 65364857
4-amino-N-(3,5-dimethoxyphenyl)-1-methylpyrrole-2-carboxamide
CID 43642860
5-methoxy-1-methylpyrrol-2-amine
CID 69341825
4-amino-N-(2-methoxyethyl)-1-methylpyrrole-2-carboxamide
CID 43641937
tert-butyl 4-amino-1-methylpyrrole-2-carboxylate
CID 45089376
(3,4-dimethoxyphenyl)methyl 4-amino-1-methylpyrrole-2-carboxylate
CID 61322696

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-methylpyrrol-3-amine?
The IUPAC name of 5-methoxy-1-methylpyrrol-3-amine (CID 69339573) is 5-methoxy-1-methylpyrrol-3-amine.
What is the SMILES notation for 5-methoxy-1-methylpyrrol-3-amine?
The canonical SMILES for 5-methoxy-1-methylpyrrol-3-amine is COc1cc(N)cn1C.
What is the InChIKey of 5-methoxy-1-methylpyrrol-3-amine?
The InChIKey is MAVHMEQIZADABH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-8-4-5(7)3-6(8)9-2/h3-4H,7H2,1-2H3.
What are the key properties of 5-methoxy-1-methylpyrrol-3-amine?
5-methoxy-1-methylpyrrol-3-amine has a molecular weight of 126.16 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-methylpyrrol-3-amine is sourced from PubChem (CID 69339573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).