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

C16H15NO3 — CID 32578805

IUPAC(2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide
SMILESO=C(NOCc1ccccc1)[C@H]1Cc2ccccc2O1
InChIInChI=1S/C16H15NO3/c18-16(17-19-11-12-6-2-1-3-7-12)15-10-13-8-4-5-9-14(13)20-15/h1-9,15H,10-11H2,(H,17,18)/t15-/m1/s1
InChIKeyWVUBEKPCDSHCPK-OAHLLOKOSA-N
MW269.30 g/mol
LogP2.24
Rot. Bonds4

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

(2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide (PubChem CID 32578805) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide
PubChem CID32578805
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC Name(2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide
SMILESO=C(NOCc1ccccc1)[C@H]1Cc2ccccc2O1
InChIInChI=1S/C16H15NO3/c18-16(17-19-11-12-6-2-1-3-7-12)15-10-13-8-4-5-9-14(13)20-15/h1-9,15H,10-11H2,(H,17,18)/t15-/m1/s1
InChIKeyWVUBEKPCDSHCPK-OAHLLOKOSA-N
XLogP2.24
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(3S)-1-oxo-N-phenylmethoxy-3,4-dihydroisochromene-3-carboxamide
CID 95276381
N-[4-(aminomethyl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 18070767
N-[[3-(aminomethyl)phenyl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 43589376
N-phenylmethoxy-1,4-dioxane-2-carboxamide
CID 60756176
N-[(3-phenylmethoxyphenyl)-sulfanylcarbamoyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 87660083
N-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 43208767
N-(2-bromoethyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 43133406
(3R)-N-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 11044233
(2R,3S)-2-[[(2R)-2,3-dihydro-1-benzofuran-2-carbonyl]amino]-3-methylpentanoic acid
CID 124838129
N-(3-methylbutan-2-yl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 47127876
N-(cyanomethyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 60896123
N-(3-amino-2,2-dimethylpropyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 113295190

Frequently Asked Questions

What is the IUPAC name of (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide?
The IUPAC name of (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide (CID 32578805) is (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide.
What is the SMILES notation for (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide?
The canonical SMILES for (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide is O=C(NOCc1ccccc1)[C@H]1Cc2ccccc2O1.
What is the InChIKey of (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide?
The InChIKey is WVUBEKPCDSHCPK-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H15NO3/c18-16(17-19-11-12-6-2-1-3-7-12)15-10-13-8-4-5-9-14(13)20-15/h1-9,15H,10-11H2,(H,17,18)/t15-/m1/s1.
What are the key properties of (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide?
(2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-phenylmethoxy-2,3-dihydro-1-benzofuran-2-carboxamide is sourced from PubChem (CID 32578805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).