cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone

C11H10N2O — CID 69009468

IUPACcyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone
SMILESO=C(c1ccc2cc[nH]c2n1)C1CC1
InChIInChI=1S/C11H10N2O/c14-10(7-1-2-7)9-4-3-8-5-6-12-11(8)13-9/h3-7H,1-2H2,(H,12,13)
InChIKeyUVZDNZTUTSUDFB-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.16
Rot. Bonds2

About cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone

cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone (PubChem CID 69009468) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone.

Molecular Properties

Compound Namecyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone
PubChem CID69009468
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Namecyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone
SMILESO=C(c1ccc2cc[nH]c2n1)C1CC1
InChIInChI=1S/C11H10N2O/c14-10(7-1-2-7)9-4-3-8-5-6-12-11(8)13-9/h3-7H,1-2H2,(H,12,13)
InChIKeyUVZDNZTUTSUDFB-UHFFFAOYSA-N
XLogP2.16
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone?
The IUPAC name of cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone (CID 69009468) is cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone.
What is the SMILES notation for cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone?
The canonical SMILES for cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone is O=C(c1ccc2cc[nH]c2n1)C1CC1.
What is the InChIKey of cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone?
The InChIKey is UVZDNZTUTSUDFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c14-10(7-1-2-7)9-4-3-8-5-6-12-11(8)13-9/h3-7H,1-2H2,(H,12,13).
What are the key properties of cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone?
cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone has a molecular weight of 186.21 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl(1H-pyrrolo[2,3-b]pyridin-6-yl)methanone is sourced from PubChem (CID 69009468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).