2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide

C12H20N4O — CID 64858172

IUPAC2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide
SMILESCCc1nc2c(n1C(C)(C)C(N)=O)CCNC2
InChIInChI=1S/C12H20N4O/c1-4-10-15-8-7-14-6-5-9(8)16(10)12(2,3)11(13)17/h14H,4-7H2,1-3H3,(H2,13,17)
InChIKeyVEGWBKIQHKPGSF-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.31
Rot. Bonds3

About 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide

2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide (PubChem CID 64858172) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide.

Molecular Properties

Compound Name2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide
PubChem CID64858172
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide
SMILESCCc1nc2c(n1C(C)(C)C(N)=O)CCNC2
InChIInChI=1S/C12H20N4O/c1-4-10-15-8-7-14-6-5-9(8)16(10)12(2,3)11(13)17/h14H,4-7H2,1-3H3,(H2,13,17)
InChIKeyVEGWBKIQHKPGSF-UHFFFAOYSA-N
XLogP0.31
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide?
The IUPAC name of 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide (CID 64858172) is 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide.
What is the SMILES notation for 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide?
The canonical SMILES for 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide is CCc1nc2c(n1C(C)(C)C(N)=O)CCNC2.
What is the InChIKey of 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide?
The InChIKey is VEGWBKIQHKPGSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-4-10-15-8-7-14-6-5-9(8)16(10)12(2,3)11(13)17/h14H,4-7H2,1-3H3,(H2,13,17).
What are the key properties of 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide?
2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide has a molecular weight of 236.32 g/mol, XLogP of 0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)-2-methylpropanamide is sourced from PubChem (CID 64858172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).