2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine

C9H12N4 — CID 79821418

IUPAC2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCCc1nc2nc(NC)ccc2[nH]1
InChIInChI=1S/C9H12N4/c1-3-7-11-6-4-5-8(10-2)13-9(6)12-7/h4-5H,3H2,1-2H3,(H2,10,11,12,13)
InChIKeyKNSPZAQBPZYWND-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.56
Rot. Bonds2

About 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine

2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79821418) has the molecular formula C9H12N4 and a molecular weight of 176.22 g/mol. Its IUPAC name is 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79821418
Molecular FormulaC9H12N4
Molecular Weight176.22 g/mol
Exact Mass176.11
IUPAC Name2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCCc1nc2nc(NC)ccc2[nH]1
InChIInChI=1S/C9H12N4/c1-3-7-11-6-4-5-8(10-2)13-9(6)12-7/h4-5H,3H2,1-2H3,(H2,10,11,12,13)
InChIKeyKNSPZAQBPZYWND-UHFFFAOYSA-N
XLogP1.56
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine (CID 79821418) is 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine is CCc1nc2nc(NC)ccc2[nH]1.
What is the InChIKey of 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is KNSPZAQBPZYWND-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4/c1-3-7-11-6-4-5-8(10-2)13-9(6)12-7/h4-5H,3H2,1-2H3,(H2,10,11,12,13).
What are the key properties of 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine?
2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 176.22 g/mol, XLogP of 1.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79821418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).