(2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide

C15H14N2O3 — CID 95298416

IUPAC(2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide
SMILESCOc1cccnc1NC(=O)[C@H]1Cc2ccccc2O1
InChIInChI=1S/C15H14N2O3/c1-19-12-7-4-8-16-14(12)17-15(18)13-9-10-5-2-3-6-11(10)20-13/h2-8,13H,9H2,1H3,(H,16,17,18)/t13-/m1/s1
InChIKeyPMMVQZQRSWWBFQ-CYBMUJFWSA-N
MW270.29 g/mol
LogP2.03
Rot. Bonds3

About (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide

(2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide (PubChem CID 95298416) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide
PubChem CID95298416
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name(2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide
SMILESCOc1cccnc1NC(=O)[C@H]1Cc2ccccc2O1
InChIInChI=1S/C15H14N2O3/c1-19-12-7-4-8-16-14(12)17-15(18)13-9-10-5-2-3-6-11(10)20-13/h2-8,13H,9H2,1H3,(H,16,17,18)/t13-/m1/s1
InChIKeyPMMVQZQRSWWBFQ-CYBMUJFWSA-N
XLogP2.03
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide?
The IUPAC name of (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide (CID 95298416) is (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide.
What is the SMILES notation for (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide?
The canonical SMILES for (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide is COc1cccnc1NC(=O)[C@H]1Cc2ccccc2O1.
What is the InChIKey of (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide?
The InChIKey is PMMVQZQRSWWBFQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-19-12-7-4-8-16-14(12)17-15(18)13-9-10-5-2-3-6-11(10)20-13/h2-8,13H,9H2,1H3,(H,16,17,18)/t13-/m1/s1.
What are the key properties of (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide?
(2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-methoxy-2-pyridinyl)-2,3-dihydro-1-benzofuran-2-carboxamide is sourced from PubChem (CID 95298416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).