3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane

C15H24N2 — CID 167522006

IUPAC3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane
SMILESCC.CC.Cn1cc(C2CC2)c2ccncc21
InChIInChI=1S/C11H12N2.2C2H6/c1-13-7-10(8-2-3-8)9-4-5-12-6-11(9)13;2*1-2/h4-8H,2-3H2,1H3;2*1-2H3
InChIKeyWCMBXBQWOYOPNT-UHFFFAOYSA-N
MW232.37 g/mol
LogP4.50
Rot. Bonds1

About 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane

3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane (PubChem CID 167522006) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane.

Molecular Properties

Compound Name3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane
PubChem CID167522006
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane
SMILESCC.CC.Cn1cc(C2CC2)c2ccncc21
InChIInChI=1S/C11H12N2.2C2H6/c1-13-7-10(8-2-3-8)9-4-5-12-6-11(9)13;2*1-2/h4-8H,2-3H2,1H3;2*1-2H3
InChIKeyWCMBXBQWOYOPNT-UHFFFAOYSA-N
XLogP4.50
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane?
The IUPAC name of 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane (CID 167522006) is 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane.
What is the SMILES notation for 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane?
The canonical SMILES for 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane is CC.CC.Cn1cc(C2CC2)c2ccncc21.
What is the InChIKey of 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane?
The InChIKey is WCMBXBQWOYOPNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2.2C2H6/c1-13-7-10(8-2-3-8)9-4-5-12-6-11(9)13;2*1-2/h4-8H,2-3H2,1H3;2*1-2H3.
What are the key properties of 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane?
3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane has a molecular weight of 232.37 g/mol, XLogP of 4.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridine;ethane is sourced from PubChem (CID 167522006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).