6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine

C10H14N6 — CID 70257388

IUPAC6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine
SMILESCC1c2c(ccn2-c2nn[nH]n2)CCN1C
InChIInChI=1S/C10H14N6/c1-7-9-8(3-5-15(7)2)4-6-16(9)10-11-13-14-12-10/h4,6-7H,3,5H2,1-2H3,(H,11,12,13,14)
InChIKeyQZUFHKQLXMDSNB-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.54
Rot. Bonds1

About 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine

6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine (PubChem CID 70257388) has the molecular formula C10H14N6 and a molecular weight of 218.26 g/mol. Its IUPAC name is 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine
PubChem CID70257388
Molecular FormulaC10H14N6
Molecular Weight218.26 g/mol
Exact Mass218.13
IUPAC Name6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine
SMILESCC1c2c(ccn2-c2nn[nH]n2)CCN1C
InChIInChI=1S/C10H14N6/c1-7-9-8(3-5-15(7)2)4-6-16(9)10-11-13-14-12-10/h4,6-7H,3,5H2,1-2H3,(H,11,12,13,14)
InChIKeyQZUFHKQLXMDSNB-UHFFFAOYSA-N
XLogP0.54
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine?
The IUPAC name of 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine (CID 70257388) is 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine.
What is the SMILES notation for 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine?
The canonical SMILES for 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine is CC1c2c(ccn2-c2nn[nH]n2)CCN1C.
What is the InChIKey of 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine?
The InChIKey is QZUFHKQLXMDSNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6/c1-7-9-8(3-5-15(7)2)4-6-16(9)10-11-13-14-12-10/h4,6-7H,3,5H2,1-2H3,(H,11,12,13,14).
What are the key properties of 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine?
6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine has a molecular weight of 218.26 g/mol, XLogP of 0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-1-(2H-tetrazol-5-yl)-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 70257388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).