N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine

C10H13N3 — CID 84766983

IUPACN-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine
SMILESCNCCc1cnc2cc[nH]c2c1
InChIInChI=1S/C10H13N3/c1-11-4-2-8-6-10-9(13-7-8)3-5-12-10/h3,5-7,11-12H,2,4H2,1H3
InChIKeyPGQVDFMIHCOXFJ-UHFFFAOYSA-N
MW175.24 g/mol
LogP1.32
Rot. Bonds3

About N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine

N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine (PubChem CID 84766983) has the molecular formula C10H13N3 and a molecular weight of 175.24 g/mol. Its IUPAC name is N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine
PubChem CID84766983
Molecular FormulaC10H13N3
Molecular Weight175.24 g/mol
Exact Mass175.11
IUPAC NameN-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine
SMILESCNCCc1cnc2cc[nH]c2c1
InChIInChI=1S/C10H13N3/c1-11-4-2-8-6-10-9(13-7-8)3-5-12-10/h3,5-7,11-12H,2,4H2,1H3
InChIKeyPGQVDFMIHCOXFJ-UHFFFAOYSA-N
XLogP1.32
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.24
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanol
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CID 84771256
2-(1H-indol-5-yl)-N-methylethanamine
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ethane;6-methyl-1H-pyrrolo[3,2-b]pyridine;propane
CID 142447462
2-(methylamino)-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanol
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6-[2-(methylamino)ethyl]-1H-quinoxalin-2-one
CID 117291697
(1R)-1-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethane-1,2-diamine
CID 97056959
3-(1H-pyrrolo[3,2-b]pyridin-6-yl)butan-1-amine
CID 84771242
3-amino-1-(1H-pyrrolo[3,2-b]pyridin-6-yl)propane-1,2-diol
CID 170828191
N-methyl-2-(5-methyl-3-pyridinyl)ethanamine
CID 82594770
2-[4-(3H-benzimidazol-5-yl)pyrimidin-2-yl]-N-methylethanamine
CID 116897787
N'-(3H-benzimidazol-5-ylmethyl)-N-methylmethanediamine
CID 115226891

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine?
The IUPAC name of N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine (CID 84766983) is N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine?
The canonical SMILES for N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine is CNCCc1cnc2cc[nH]c2c1.
What is the InChIKey of N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine?
The InChIKey is PGQVDFMIHCOXFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-11-4-2-8-6-10-9(13-7-8)3-5-12-10/h3,5-7,11-12H,2,4H2,1H3.
What are the key properties of N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine?
N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine has a molecular weight of 175.24 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1H-pyrrolo[3,2-b]pyridin-6-yl)ethanamine is sourced from PubChem (CID 84766983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).