4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid

C10H15N3O2 — CID 19783584

IUPAC4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid
SMILESCN1C(C(=O)O)Cc2[nH]cnc2C1(C)C
InChIInChI=1S/C10H15N3O2/c1-10(2)8-6(11-5-12-8)4-7(9(14)15)13(10)3/h5,7H,4H2,1-3H3,(H,11,12)(H,14,15)
InChIKeyLJWFVTYLPPKZHF-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.59
Rot. Bonds1

About 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid

4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid (PubChem CID 19783584) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid
PubChem CID19783584
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid
SMILESCN1C(C(=O)O)Cc2[nH]cnc2C1(C)C
InChIInChI=1S/C10H15N3O2/c1-10(2)8-6(11-5-12-8)4-7(9(14)15)13(10)3/h5,7H,4H2,1-3H3,(H,11,12)(H,14,15)
InChIKeyLJWFVTYLPPKZHF-UHFFFAOYSA-N
XLogP0.59
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid?
The IUPAC name of 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid (CID 19783584) is 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid.
What is the SMILES notation for 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid?
The canonical SMILES for 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid is CN1C(C(=O)O)Cc2[nH]cnc2C1(C)C.
What is the InChIKey of 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid?
The InChIKey is LJWFVTYLPPKZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-10(2)8-6(11-5-12-8)4-7(9(14)15)13(10)3/h5,7H,4H2,1-3H3,(H,11,12)(H,14,15).
What are the key properties of 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid?
4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid has a molecular weight of 209.25 g/mol, XLogP of 0.59, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,5-trimethyl-6,7-dihydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid is sourced from PubChem (CID 19783584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).