1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine

C10H13N3 — CID 84766992

IUPAC1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine
SMILESCC(N)c1cnc2ccn(C)c2c1
InChIInChI=1S/C10H13N3/c1-7(11)8-5-10-9(12-6-8)3-4-13(10)2/h3-7H,11H2,1-2H3
InChIKeyVVTFAFRBLXDAID-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.59
Rot. Bonds1

About 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine

1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine (PubChem CID 84766992) has the molecular formula C10H13N3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine.

Molecular Properties

Compound Name1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine
PubChem CID84766992
Molecular FormulaC10H13N3
Molecular Weight175.23 g/mol
Exact Mass175.11
IUPAC Name1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine
SMILESCC(N)c1cnc2ccn(C)c2c1
InChIInChI=1S/C10H13N3/c1-7(11)8-5-10-9(12-6-8)3-4-13(10)2/h3-7H,11H2,1-2H3
InChIKeyVVTFAFRBLXDAID-UHFFFAOYSA-N
XLogP1.59
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-methylpyrrolo[3,2-b]pyridin-6-yl)propan-1-amine
CID 84771244
1-methylpyrrolo[3,2-b]pyridine-6-carbaldehyde
CID 84716725
(1S)-1-(1-methylbenzimidazol-5-yl)ethanamine
CID 95992488
(1R)-1-(6-iodo-5-methyl-3-pyridinyl)ethanamine
CID 124503157
(1S)-1-[1-methyl-6-(2-methylpyrazol-3-yl)pyrrolo[3,2-b]pyridin-5-yl]ethanamine
CID 86707969
1-(3-methylbenzimidazol-5-yl)ethane-1,2-diamine
CID 82403859
(1R)-1-(1-methylpyrazolo[3,4-b]pyridin-5-yl)ethanamine
CID 165403100
5-methyl-3-propan-2-ylpyrrolo[2,3-b]pyrazine
CID 178008387
1-methyl-7-propan-2-ylquinoxalin-2-one
CID 58229471
(1S)-1-furo[2,3-b]pyridin-5-ylethanamine
CID 122237100
2-methoxy-5-methylpyrrolo[3,2-d]pyrimidine
CID 137400076
5-[(1R)-1-aminoethyl]-3-bromopyridin-2-amine
CID 130766270

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine?
The IUPAC name of 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine (CID 84766992) is 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine.
What is the SMILES notation for 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine?
The canonical SMILES for 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine is CC(N)c1cnc2ccn(C)c2c1.
What is the InChIKey of 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine?
The InChIKey is VVTFAFRBLXDAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-7(11)8-5-10-9(12-6-8)3-4-13(10)2/h3-7H,11H2,1-2H3.
What are the key properties of 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine?
1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine has a molecular weight of 175.23 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrrolo[3,2-b]pyridin-6-yl)ethanamine is sourced from PubChem (CID 84766992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).