4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide

C19H22N3O2P — CID 170151570

IUPAC4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide
SMILESCNC(=O)c1cc(P)c(-c2nc3cc(C)ccn3c2C)c(OC)c1C
InChIInChI=1S/C19H22N3O2P/c1-10-6-7-22-12(3)17(21-15(22)8-10)16-14(25)9-13(19(23)20-4)11(2)18(16)24-5/h6-9H,25H2,1-5H3,(H,20,23)
InChIKeyAFAUHFRGWCZYJL-UHFFFAOYSA-N
MW355.38 g/mol
LogP2.80
Rot. Bonds3

About 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide

4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide (PubChem CID 170151570) has the molecular formula C19H22N3O2P and a molecular weight of 355.38 g/mol. Its IUPAC name is 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide.

Molecular Properties

Compound Name4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide
PubChem CID170151570
Molecular FormulaC19H22N3O2P
Molecular Weight355.38 g/mol
Exact Mass355.14
IUPAC Name4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide
SMILESCNC(=O)c1cc(P)c(-c2nc3cc(C)ccn3c2C)c(OC)c1C
InChIInChI=1S/C19H22N3O2P/c1-10-6-7-22-12(3)17(21-15(22)8-10)16-14(25)9-13(19(23)20-4)11(2)18(16)24-5/h6-9H,25H2,1-5H3,(H,20,23)
InChIKeyAFAUHFRGWCZYJL-UHFFFAOYSA-N
XLogP2.80
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.38
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide?
The IUPAC name of 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide (CID 170151570) is 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide.
What is the SMILES notation for 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide?
The canonical SMILES for 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide is CNC(=O)c1cc(P)c(-c2nc3cc(C)ccn3c2C)c(OC)c1C.
What is the InChIKey of 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide?
The InChIKey is AFAUHFRGWCZYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N3O2P/c1-10-6-7-22-12(3)17(21-15(22)8-10)16-14(25)9-13(19(23)20-4)11(2)18(16)24-5/h6-9H,25H2,1-5H3,(H,20,23).
What are the key properties of 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide?
4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide has a molecular weight of 355.38 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-3-methoxy-N,2-dimethyl-5-phosphanylbenzamide is sourced from PubChem (CID 170151570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).