N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide

C17H18N4O — CID 155526697

IUPACN-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide
SMILESCCN(C(=O)CCc1nc2ncccc2[nH]1)c1ccccc1
InChIInChI=1S/C17H18N4O/c1-2-21(13-7-4-3-5-8-13)16(22)11-10-15-19-14-9-6-12-18-17(14)20-15/h3-9,12H,2,10-11H2,1H3,(H,18,19,20)
InChIKeyFLQFGOAHHDRFGE-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.94
Rot. Bonds5

About N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide

N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide (PubChem CID 155526697) has the molecular formula C17H18N4O and a molecular weight of 294.36 g/mol. Its IUPAC name is N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide.

Molecular Properties

Compound NameN-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide
PubChem CID155526697
Molecular FormulaC17H18N4O
Molecular Weight294.36 g/mol
Exact Mass294.15
IUPAC NameN-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide
SMILESCCN(C(=O)CCc1nc2ncccc2[nH]1)c1ccccc1
InChIInChI=1S/C17H18N4O/c1-2-21(13-7-4-3-5-8-13)16(22)11-10-15-19-14-9-6-12-18-17(14)20-15/h3-9,12H,2,10-11H2,1H3,(H,18,19,20)
InChIKeyFLQFGOAHHDRFGE-UHFFFAOYSA-N
XLogP2.94
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide?
The IUPAC name of N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide (CID 155526697) is N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide.
What is the SMILES notation for N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide?
The canonical SMILES for N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide is CCN(C(=O)CCc1nc2ncccc2[nH]1)c1ccccc1.
What is the InChIKey of N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide?
The InChIKey is FLQFGOAHHDRFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O/c1-2-21(13-7-4-3-5-8-13)16(22)11-10-15-19-14-9-6-12-18-17(14)20-15/h3-9,12H,2,10-11H2,1H3,(H,18,19,20).
What are the key properties of N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide?
N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide has a molecular weight of 294.36 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(1H-imidazo[4,5-b]pyridin-2-yl)-N-phenylpropanamide is sourced from PubChem (CID 155526697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).