1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine

C10H14N2 — CID 14177029

IUPAC1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine
SMILESCc1cc(C)c2c(n1)N(C)CC2
InChIInChI=1S/C10H14N2/c1-7-6-8(2)11-10-9(7)4-5-12(10)3/h6H,4-5H2,1-3H3
InChIKeyFNUIFYSYAAXGNT-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.69
Rot. Bonds

About 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine

1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine (PubChem CID 14177029) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine
PubChem CID14177029
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine
SMILESCc1cc(C)c2c(n1)N(C)CC2
InChIInChI=1S/C10H14N2/c1-7-6-8(2)11-10-9(7)4-5-12(10)3/h6H,4-5H2,1-3H3
InChIKeyFNUIFYSYAAXGNT-UHFFFAOYSA-N
XLogP1.69
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The IUPAC name of 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine (CID 14177029) is 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine.
What is the SMILES notation for 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The canonical SMILES for 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine is Cc1cc(C)c2c(n1)N(C)CC2.
What is the InChIKey of 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine?
The InChIKey is FNUIFYSYAAXGNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-7-6-8(2)11-10-9(7)4-5-12(10)3/h6H,4-5H2,1-3H3.
What are the key properties of 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine?
1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine has a molecular weight of 162.24 g/mol, XLogP of 1.69, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,6-trimethyl-2,3-dihydropyrrolo[2,3-b]pyridine is sourced from PubChem (CID 14177029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).