1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride

C7H13Cl2N3 — CID 13150255

IUPAC1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride
SMILESCl.Cl.Cn1cnc2c1CCNC2
InChIInChI=1S/C7H11N3.2ClH/c1-10-5-9-6-4-8-3-2-7(6)10;;/h5,8H,2-4H2,1H3;2*1H
InChIKeyZKVLOJXPCWMCBV-UHFFFAOYSA-N
MW210.11 g/mol
LogP0.91
Rot. Bonds

About 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride

1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride (PubChem CID 13150255) has the molecular formula C7H13Cl2N3 and a molecular weight of 210.11 g/mol. Its IUPAC name is 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride.

Molecular Properties

Compound Name1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride
PubChem CID13150255
Molecular FormulaC7H13Cl2N3
Molecular Weight210.11 g/mol
Exact Mass209.05
IUPAC Name1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride
SMILESCl.Cl.Cn1cnc2c1CCNC2
InChIInChI=1S/C7H11N3.2ClH/c1-10-5-9-6-4-8-3-2-7(6)10;;/h5,8H,2-4H2,1H3;2*1H
InChIKeyZKVLOJXPCWMCBV-UHFFFAOYSA-N
XLogP0.91
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.11
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride?
The IUPAC name of 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride (CID 13150255) is 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride.
What is the SMILES notation for 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride?
The canonical SMILES for 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride is Cl.Cl.Cn1cnc2c1CCNC2.
What is the InChIKey of 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride?
The InChIKey is ZKVLOJXPCWMCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3.2ClH/c1-10-5-9-6-4-8-3-2-7(6)10;;/h5,8H,2-4H2,1H3;2*1H.
What are the key properties of 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride?
1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride has a molecular weight of 210.11 g/mol, XLogP of 0.91, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine;dihydrochloride is sourced from PubChem (CID 13150255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).