1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide

C19H17N3O2 — CID 122653465

IUPAC1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide
SMILESNC(=O)c1cccc2c1CCN2c1cc(Cc2ccco2)ccn1
InChIInChI=1S/C19H17N3O2/c20-19(23)16-4-1-5-17-15(16)7-9-22(17)18-12-13(6-8-21-18)11-14-3-2-10-24-14/h1-6,8,10,12H,7,9,11H2,(H2,20,23)
InChIKeyYEHJXXSCSKCYIZ-UHFFFAOYSA-N
MW319.36 g/mol
LogP3.06
Rot. Bonds4

About 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide

1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide (PubChem CID 122653465) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide.

Molecular Properties

Compound Name1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide
PubChem CID122653465
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC Name1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide
SMILESNC(=O)c1cccc2c1CCN2c1cc(Cc2ccco2)ccn1
InChIInChI=1S/C19H17N3O2/c20-19(23)16-4-1-5-17-15(16)7-9-22(17)18-12-13(6-8-21-18)11-14-3-2-10-24-14/h1-6,8,10,12H,7,9,11H2,(H2,20,23)
InChIKeyYEHJXXSCSKCYIZ-UHFFFAOYSA-N
XLogP3.06
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide?
The IUPAC name of 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide (CID 122653465) is 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide.
What is the SMILES notation for 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide?
The canonical SMILES for 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide is NC(=O)c1cccc2c1CCN2c1cc(Cc2ccco2)ccn1.
What is the InChIKey of 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide?
The InChIKey is YEHJXXSCSKCYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c20-19(23)16-4-1-5-17-15(16)7-9-22(17)18-12-13(6-8-21-18)11-14-3-2-10-24-14/h1-6,8,10,12H,7,9,11H2,(H2,20,23).
What are the key properties of 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide?
1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide has a molecular weight of 319.36 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(furan-2-ylmethyl)-2-pyridinyl]-2,3-dihydroindole-4-carboxamide is sourced from PubChem (CID 122653465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).