1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine

C11H12N2 — CID 76852301

IUPAC1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine
SMILESc1cnc2c(c1)ccn2CC1CC1
InChIInChI=1S/C11H12N2/c1-2-10-5-7-13(8-9-3-4-9)11(10)12-6-1/h1-2,5-7,9H,3-4,8H2
InChIKeyUZYCHXSNBMOGKQ-UHFFFAOYSA-N
MW172.23 g/mol
LogP2.45
Rot. Bonds2

About 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine

1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine (PubChem CID 76852301) has the molecular formula C11H12N2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine
PubChem CID76852301
Molecular FormulaC11H12N2
Molecular Weight172.23 g/mol
Exact Mass172.10
IUPAC Name1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine
SMILESc1cnc2c(c1)ccn2CC1CC1
InChIInChI=1S/C11H12N2/c1-2-10-5-7-13(8-9-3-4-9)11(10)12-6-1/h1-2,5-7,9H,3-4,8H2
InChIKeyUZYCHXSNBMOGKQ-UHFFFAOYSA-N
XLogP2.45
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine?
The IUPAC name of 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine (CID 76852301) is 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine?
The canonical SMILES for 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine is c1cnc2c(c1)ccn2CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine?
The InChIKey is UZYCHXSNBMOGKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2/c1-2-10-5-7-13(8-9-3-4-9)11(10)12-6-1/h1-2,5-7,9H,3-4,8H2.
What are the key properties of 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine?
1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine has a molecular weight of 172.23 g/mol, XLogP of 2.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 76852301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).