2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol

C11H15N3O — CID 66411195

IUPAC2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol
SMILESCNCc1cn(CCO)c2ncccc12
InChIInChI=1S/C11H15N3O/c1-12-7-9-8-14(5-6-15)11-10(9)3-2-4-13-11/h2-4,8,12,15H,5-7H2,1H3
InChIKeyIFKMJCPCRLUUOG-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.75
Rot. Bonds4

About 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol

2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol (PubChem CID 66411195) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol
PubChem CID66411195
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol
SMILESCNCc1cn(CCO)c2ncccc12
InChIInChI=1S/C11H15N3O/c1-12-7-9-8-14(5-6-15)11-10(9)3-2-4-13-11/h2-4,8,12,15H,5-7H2,1H3
InChIKeyIFKMJCPCRLUUOG-UHFFFAOYSA-N
XLogP0.75
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]butan-1-ol
CID 66413359
5-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]pentan-1-ol
CID 66411011
3-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]propanamide
CID 66412968
N-methyl-1-[1-[2-(2,2,2-trifluoroethoxy)ethyl]pyrrolo[2,3-b]pyridin-3-yl]methanamine
CID 66413562
2,2-dimethyl-3-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]propanoic acid
CID 79621679
1-[1-[(3,5-difluorophenyl)methyl]pyrrolo[2,3-b]pyridin-3-yl]-N-methylmethanamine
CID 105405146
N-[[1-(2-morpholin-4-ylethyl)pyrrolo[2,3-b]pyridin-3-yl]methyl]ethanamine
CID 66411997
5-[3-[(2-methylpropylamino)methyl]pyrrolo[2,3-b]pyridin-1-yl]pentan-1-ol
CID 66413411
1-[1-(difluoromethyl)pyrrolo[2,3-b]pyridin-3-yl]-N-methylmethanamine
CID 66411193
N-[[1-(2-pyrazol-1-ylethyl)pyrrolo[2,3-b]pyridin-3-yl]methyl]ethanamine
CID 66412190
N-[(1-octylpyrrolo[2,3-b]pyridin-3-yl)methyl]ethanamine
CID 66411018
[1-[2-(dimethylamino)ethyl]pyrrolo[2,3-b]pyridin-3-yl]methanol
CID 66415275

Frequently Asked Questions

What is the IUPAC name of 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol?
The IUPAC name of 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol (CID 66411195) is 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol.
What is the SMILES notation for 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol?
The canonical SMILES for 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol is CNCc1cn(CCO)c2ncccc12.
What is the InChIKey of 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol?
The InChIKey is IFKMJCPCRLUUOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-12-7-9-8-14(5-6-15)11-10(9)3-2-4-13-11/h2-4,8,12,15H,5-7H2,1H3.
What are the key properties of 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol?
2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol has a molecular weight of 205.26 g/mol, XLogP of 0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methylaminomethyl)pyrrolo[2,3-b]pyridin-1-yl]ethanol is sourced from PubChem (CID 66411195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).