3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane

C11H16N2 — CID 144820313

IUPAC3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane
SMILESCC.Cc1ccc2[nH]cc(C)c2n1
InChIInChI=1S/C9H10N2.C2H6/c1-6-5-10-8-4-3-7(2)11-9(6)8;1-2/h3-5,10H,1-2H3;1-2H3
InChIKeyUTIWRYWVZQXOBJ-UHFFFAOYSA-N
MW176.26 g/mol
LogP3.21
Rot. Bonds

About 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane

3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane (PubChem CID 144820313) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane.

Molecular Properties

Compound Name3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane
PubChem CID144820313
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane
SMILESCC.Cc1ccc2[nH]cc(C)c2n1
InChIInChI=1S/C9H10N2.C2H6/c1-6-5-10-8-4-3-7(2)11-9(6)8;1-2/h3-5,10H,1-2H3;1-2H3
InChIKeyUTIWRYWVZQXOBJ-UHFFFAOYSA-N
XLogP3.21
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-chloro-5-methyl-1H-pyrrolo[3,2-b]pyridine
CID 53412640
(5-methyl-1H-pyrrolo[3,2-b]pyridin-3-yl) carbamate
CID 175391117
2,5-dimethyl-3-methylsulfanyl-1H-pyrrolo[3,2-b]pyridine
CID 130335982
2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one
CID 11148828
3,5-dimethylfuro[3,2-b]pyridine;ethane
CID 172623163
7-methyl-5H-pyrrolo[3,2-d]pyrimidine
CID 58957259
5-(3,6-dimethyl-1H-pyrrolo[3,2-b]pyridin-5-yl)-6-ethyl-N,N-dimethylpyridin-2-amine
CID 143015233
4-hydroxy-3,6-dimethyl-1H-1,5-naphthyridin-2-one
CID 89049721
ethane;3-methyl-1H-pyrrolo[3,2-c]pyridine
CID 143713533
3,5-dimethyl-1H-indole
CID 142943492
3,4-dimethyl-1H-indole;ethane
CID 143293593
4-methyl-8-selena-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 159563538

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane?
The IUPAC name of 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane (CID 144820313) is 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane.
What is the SMILES notation for 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane?
The canonical SMILES for 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane is CC.Cc1ccc2[nH]cc(C)c2n1.
What is the InChIKey of 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane?
The InChIKey is UTIWRYWVZQXOBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2.C2H6/c1-6-5-10-8-4-3-7(2)11-9(6)8;1-2/h3-5,10H,1-2H3;1-2H3.
What are the key properties of 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane?
3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane has a molecular weight of 176.26 g/mol, XLogP of 3.21, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1H-pyrrolo[3,2-b]pyridine;ethane is sourced from PubChem (CID 144820313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).