1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol

C10H14N2O — CID 10877701

IUPAC1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol
SMILESCc1nc2c(c(C)c1O)CCN2C
InChIInChI=1S/C10H14N2O/c1-6-8-4-5-12(3)10(8)11-7(2)9(6)13/h13H,4-5H2,1-3H3
InChIKeyGDUBMBRHFKQUHM-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.40
Rot. Bonds

About 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol

1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol (PubChem CID 10877701) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol.

Molecular Properties

Compound Name1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol
PubChem CID10877701
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol
SMILESCc1nc2c(c(C)c1O)CCN2C
InChIInChI=1S/C10H14N2O/c1-6-8-4-5-12(3)10(8)11-7(2)9(6)13/h13H,4-5H2,1-3H3
InChIKeyGDUBMBRHFKQUHM-UHFFFAOYSA-N
XLogP1.40
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol?
The IUPAC name of 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol (CID 10877701) is 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol.
What is the SMILES notation for 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol?
The canonical SMILES for 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol is Cc1nc2c(c(C)c1O)CCN2C.
What is the InChIKey of 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol?
The InChIKey is GDUBMBRHFKQUHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-6-8-4-5-12(3)10(8)11-7(2)9(6)13/h13H,4-5H2,1-3H3.
What are the key properties of 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol?
1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol has a molecular weight of 178.23 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-ol is sourced from PubChem (CID 10877701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).