4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine

C10H16N2 — CID 2729783

IUPAC4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
SMILESCC1CN(C)C(C)c2cc[nH]c21
InChIInChI=1S/C10H16N2/c1-7-6-12(3)8(2)9-4-5-11-10(7)9/h4-5,7-8,11H,6H2,1-3H3
InChIKeyWVTOBSCFCZZSOE-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.12
Rot. Bonds

About 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine

4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine (PubChem CID 2729783) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine.

Molecular Properties

Compound Name4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
PubChem CID2729783
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
SMILESCC1CN(C)C(C)c2cc[nH]c21
InChIInChI=1S/C10H16N2/c1-7-6-12(3)8(2)9-4-5-11-10(7)9/h4-5,7-8,11H,6H2,1-3H3
InChIKeyWVTOBSCFCZZSOE-UHFFFAOYSA-N
XLogP2.12
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine?
The IUPAC name of 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine (CID 2729783) is 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine.
What is the SMILES notation for 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine?
The canonical SMILES for 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine is CC1CN(C)C(C)c2cc[nH]c21.
What is the InChIKey of 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine?
The InChIKey is WVTOBSCFCZZSOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-7-6-12(3)8(2)9-4-5-11-10(7)9/h4-5,7-8,11H,6H2,1-3H3.
What are the key properties of 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine?
4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine has a molecular weight of 164.25 g/mol, XLogP of 2.12, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,7-trimethyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine is sourced from PubChem (CID 2729783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).