3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide

C19H18N2O3 — CID 124847738

IUPAC3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide
SMILESCc1ccoc1C(=O)N[C@H](Cn1ccccc1=O)c1ccccc1
InChIInChI=1S/C19H18N2O3/c1-14-10-12-24-18(14)19(23)20-16(15-7-3-2-4-8-15)13-21-11-6-5-9-17(21)22/h2-12,16H,13H2,1H3,(H,20,23)/t16-/m1/s1
InChIKeyLMGKZYIFGGBZQL-MRXNPFEDSA-N
MW322.36 g/mol
LogP2.92
Rot. Bonds5

About 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide

3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide (PubChem CID 124847738) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide
PubChem CID124847738
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide
SMILESCc1ccoc1C(=O)N[C@H](Cn1ccccc1=O)c1ccccc1
InChIInChI=1S/C19H18N2O3/c1-14-10-12-24-18(14)19(23)20-16(15-7-3-2-4-8-15)13-21-11-6-5-9-17(21)22/h2-12,16H,13H2,1H3,(H,20,23)/t16-/m1/s1
InChIKeyLMGKZYIFGGBZQL-MRXNPFEDSA-N
XLogP2.92
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1R)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-3-carboxamide
CID 100735320
N-[(1R)-2-imidazol-1-yl-1-phenylethyl]-3-methylfuran-2-carboxamide
CID 95197180
3-methyl-N-(3-methyl-1-phenylbutyl)furan-2-carboxamide
CID 43054971
3-(4-fluorophenyl)-3-[(3-methylfuran-2-carbonyl)amino]propanoic acid
CID 84583373
cis-(1R,3S)-2,2-dimethyl-3-[[2-(2-oxo-1-pyridinyl)-1-phenylethyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 122066942
(3S)-3-[(3-methylfuran-2-carbonyl)amino]-3-(2-methylphenyl)propanoic acid
CID 99851595
N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]-1,3-thiazole-4-carboxamide
CID 124875352
(2S)-2-[(3-methylfuran-2-carbonyl)amino]-3-phenylpropanoic acid
CID 30049147
(3R)-3-(3-bromophenyl)-3-[(3-methylfuran-2-carbonyl)amino]propanoic acid
CID 97233805
N-(2-amino-1-phenyl-2-sulfanylideneethyl)-3-methylfuran-2-carboxamide
CID 61119426
3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]furan-2-carboxamide
CID 38611766
3-methyl-N-(1-pyrazol-1-ylpropan-2-yl)furan-2-carboxamide
CID 51079611

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide?
The IUPAC name of 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide (CID 124847738) is 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide?
The canonical SMILES for 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide is Cc1ccoc1C(=O)N[C@H](Cn1ccccc1=O)c1ccccc1.
What is the InChIKey of 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide?
The InChIKey is LMGKZYIFGGBZQL-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-14-10-12-24-18(14)19(23)20-16(15-7-3-2-4-8-15)13-21-11-6-5-9-17(21)22/h2-12,16H,13H2,1H3,(H,20,23)/t16-/m1/s1.
What are the key properties of 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide?
3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(1S)-2-(2-oxo-1-pyridinyl)-1-phenylethyl]furan-2-carboxamide is sourced from PubChem (CID 124847738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).