2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide

C20H23ClN4O — CID 14390227

IUPAC2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cn1c(-c2ccc(Cl)cc2)nc2cccnc21
InChIInChI=1S/C20H23ClN4O/c1-3-12-24(13-4-2)18(26)14-25-19(15-7-9-16(21)10-8-15)23-17-6-5-11-22-20(17)25/h5-11H,3-4,12-14H2,1-2H3
InChIKeyHNMHBAFBGGDQEK-UHFFFAOYSA-N
MW370.88 g/mol
LogP4.40
Rot. Bonds7

About 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide

2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide (PubChem CID 14390227) has the molecular formula C20H23ClN4O and a molecular weight of 370.88 g/mol. Its IUPAC name is 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide
PubChem CID14390227
Molecular FormulaC20H23ClN4O
Molecular Weight370.88 g/mol
Exact Mass370.16
IUPAC Name2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cn1c(-c2ccc(Cl)cc2)nc2cccnc21
InChIInChI=1S/C20H23ClN4O/c1-3-12-24(13-4-2)18(26)14-25-19(15-7-9-16(21)10-8-15)23-17-6-5-11-22-20(17)25/h5-11H,3-4,12-14H2,1-2H3
InChIKeyHNMHBAFBGGDQEK-UHFFFAOYSA-N
XLogP4.40
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.88
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide?
The IUPAC name of 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide (CID 14390227) is 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide?
The canonical SMILES for 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide is CCCN(CCC)C(=O)Cn1c(-c2ccc(Cl)cc2)nc2cccnc21.
What is the InChIKey of 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide?
The InChIKey is HNMHBAFBGGDQEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN4O/c1-3-12-24(13-4-2)18(26)14-25-19(15-7-9-16(21)10-8-15)23-17-6-5-11-22-20(17)25/h5-11H,3-4,12-14H2,1-2H3.
What are the key properties of 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide?
2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide has a molecular weight of 370.88 g/mol, XLogP of 4.40, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-N,N-dipropylacetamide is sourced from PubChem (CID 14390227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).