3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol

C10H10N2O — CID 169453432

IUPAC3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol
SMILESOCC=Cc1cnc2[nH]ccc2c1
InChIInChI=1S/C10H10N2O/c13-5-1-2-8-6-9-3-4-11-10(9)12-7-8/h1-4,6-7,13H,5H2,(H,11,12)
InChIKeyDTDXTUCQJUXVTE-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.57
Rot. Bonds2

About 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol

3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol (PubChem CID 169453432) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol.

Molecular Properties

Compound Name3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol
PubChem CID169453432
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol
SMILESOCC=Cc1cnc2[nH]ccc2c1
InChIInChI=1S/C10H10N2O/c13-5-1-2-8-6-9-3-4-11-10(9)12-7-8/h1-4,6-7,13H,5H2,(H,11,12)
InChIKeyDTDXTUCQJUXVTE-UHFFFAOYSA-N
XLogP1.57
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(E)-2-phenylethenyl]-1H-pyrrolo[2,3-b]pyridine
CID 89409031
N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-enyl]acetamide
CID 169465580
(E)-N-methyl-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)pent-4-en-2-amine
CID 22714596
tert-butyl N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-enyl]carbamate
CID 169467631
ethyl (E)-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-enoate
CID 175662950
5-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)-1H-pyrrolo[2,3-b]pyridine
CID 158881003
ethane;(E)-3-quinolin-3-ylprop-2-en-1-ol
CID 142035517
5-ethylsulfanyl-1H-pyrrolo[2,3-b]pyridine
CID 67227937
2-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrazol-1-yl]ethanol
CID 141297630
3-(6-chloro-1H-indol-5-yl)prop-2-en-1-ol
CID 169453478
N-ethyl-1H-pyrrolo[2,3-b]pyridin-5-amine
CID 22273641
5-[(3Z)-penta-1,3-dien-2-yl]-1H-pyrrolo[2,3-b]pyridine
CID 145220213

Frequently Asked Questions

What is the IUPAC name of 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol?
The IUPAC name of 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol (CID 169453432) is 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol.
What is the SMILES notation for 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol?
The canonical SMILES for 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol is OCC=Cc1cnc2[nH]ccc2c1.
What is the InChIKey of 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol?
The InChIKey is DTDXTUCQJUXVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c13-5-1-2-8-6-9-3-4-11-10(9)12-7-8/h1-4,6-7,13H,5H2,(H,11,12).
What are the key properties of 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol?
3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol has a molecular weight of 174.20 g/mol, XLogP of 1.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol is sourced from PubChem (CID 169453432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).