4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide

C17H21N3O3 — CID 95765477

IUPAC4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide
SMILESCCOc1ccc(C(=O)N[C@@H]2CCc3nccn3C2)cc1OC
InChIInChI=1S/C17H21N3O3/c1-3-23-14-6-4-12(10-15(14)22-2)17(21)19-13-5-7-16-18-8-9-20(16)11-13/h4,6,8-10,13H,3,5,7,11H2,1-2H3,(H,19,21)/t13-/m1/s1
InChIKeyWSFWMQBCEWLBJN-CYBMUJFWSA-N
MW315.37 g/mol
LogP2.04
Rot. Bonds5

About 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide

4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide (PubChem CID 95765477) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide.

Molecular Properties

Compound Name4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide
PubChem CID95765477
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC Name4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide
SMILESCCOc1ccc(C(=O)N[C@@H]2CCc3nccn3C2)cc1OC
InChIInChI=1S/C17H21N3O3/c1-3-23-14-6-4-12(10-15(14)22-2)17(21)19-13-5-7-16-18-8-9-20(16)11-13/h4,6,8-10,13H,3,5,7,11H2,1-2H3,(H,19,21)/t13-/m1/s1
InChIKeyWSFWMQBCEWLBJN-CYBMUJFWSA-N
XLogP2.04
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide?
The IUPAC name of 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide (CID 95765477) is 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide.
What is the SMILES notation for 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide?
The canonical SMILES for 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide is CCOc1ccc(C(=O)N[C@@H]2CCc3nccn3C2)cc1OC.
What is the InChIKey of 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide?
The InChIKey is WSFWMQBCEWLBJN-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-3-23-14-6-4-12(10-15(14)22-2)17(21)19-13-5-7-16-18-8-9-20(16)11-13/h4,6,8-10,13H,3,5,7,11H2,1-2H3,(H,19,21)/t13-/m1/s1.
What are the key properties of 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide?
4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide has a molecular weight of 315.37 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-3-methoxy-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]benzamide is sourced from PubChem (CID 95765477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).