4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine

C7H10N2 — CID 157052418

IUPAC4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine
SMILESC1=NC2=C(C1)CNCC2
InChIInChI=1S/C7H10N2/c1-4-9-7-2-3-8-5-6(1)7/h4,8H,1-3,5H2
InChIKeyBTMZOVZXBLSHFY-UHFFFAOYSA-N
MW122.17 g/mol
LogP0.71
Rot. Bonds

About 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine

4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine (PubChem CID 157052418) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine.

Molecular Properties

Compound Name4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine
PubChem CID157052418
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine
SMILESC1=NC2=C(C1)CNCC2
InChIInChI=1S/C7H10N2/c1-4-9-7-2-3-8-5-6(1)7/h4,8H,1-3,5H2
InChIKeyBTMZOVZXBLSHFY-UHFFFAOYSA-N
XLogP0.71
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methanidyl-4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridin-5-ium
CID 58124011
2,3,4,5-tetrahydro-1H-pyrrolo[2,3-c]pyridine
CID 68044282
3,4,5,6,7,8-Hexahydro-1,6-naphthyridine
CID 68747089
5-Methanimidoyl-1,2,3,6-tetrahydropyridin-4-amine
CID 89122717
3,7-Diazabicyclo[4.2.0]octa-1(6),7-diene
CID 117981270
4,5,6,7-tetrahydro-3H-pyrrolo[2,3-c]pyridine
CID 122434811
4,5,6,7-Tetrahydropyrazolo[4,3-c]pyridin-2-ium
CID 123203336
2,3,4,5-tetrahydro-1H-pyrrolo[3,4-b]pyridine
CID 141392143
4,5,6,7-tetrahydro-3H-pyrrolo[3,4-b]pyridine
CID 144707948
(4-Amino-1,2,3,6-tetrahydropyridin-5-yl)methylideneazanium
CID 149247962
4,5,6,7-tetrahydro-1H-pyrrolo[3,4-c]pyridine
CID 158411994
2,3,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine
CID 163427066

Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine?
The IUPAC name of 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine (CID 157052418) is 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine.
What is the SMILES notation for 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine?
The canonical SMILES for 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine is C1=NC2=C(C1)CNCC2.
What is the InChIKey of 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine?
The InChIKey is BTMZOVZXBLSHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-4-9-7-2-3-8-5-6(1)7/h4,8H,1-3,5H2.
What are the key properties of 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine?
4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine has a molecular weight of 122.17 g/mol, XLogP of 0.71, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydro-3H-pyrrolo[3,2-c]pyridine is sourced from PubChem (CID 157052418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).