6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide

C19H18ClN3O2 — CID 126697890

IUPAC6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2c(c1)CCO2
InChIInChI=1S/C19H18ClN3O2/c1-2-15-18(23-11-14(20)4-6-17(23)22-15)19(24)21-10-12-3-5-16-13(9-12)7-8-25-16/h3-6,9,11H,2,7-8,10H2,1H3,(H,21,24)
InChIKeyODBGNUYVHMMSDI-UHFFFAOYSA-N
MW355.83 g/mol
LogP3.41
Rot. Bonds4

About 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide

6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 126697890) has the molecular formula C19H18ClN3O2 and a molecular weight of 355.83 g/mol. Its IUPAC name is 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID126697890
Molecular FormulaC19H18ClN3O2
Molecular Weight355.83 g/mol
Exact Mass355.11
IUPAC Name6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2c(c1)CCO2
InChIInChI=1S/C19H18ClN3O2/c1-2-15-18(23-11-14(20)4-6-17(23)22-15)19(24)21-10-12-3-5-16-13(9-12)7-8-25-16/h3-6,9,11H,2,7-8,10H2,1H3,(H,21,24)
InChIKeyODBGNUYVHMMSDI-UHFFFAOYSA-N
XLogP3.41
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.83
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide (CID 126697890) is 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide is CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc2c(c1)CCO2.
What is the InChIKey of 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is ODBGNUYVHMMSDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O2/c1-2-15-18(23-11-14(20)4-6-17(23)22-15)19(24)21-10-12-3-5-16-13(9-12)7-8-25-16/h3-6,9,11H,2,7-8,10H2,1H3,(H,21,24).
What are the key properties of 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide?
6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 355.83 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-ethylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 126697890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).