2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide

C20H24N2O4 — CID 90647374

IUPAC2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide
SMILESCCc1cc(C(=O)N[C@@H]2COCC[C@@H]2OCc2ccccc2)cc(=O)[nH]1
InChIInChI=1S/C20H24N2O4/c1-2-16-10-15(11-19(23)21-16)20(24)22-17-13-25-9-8-18(17)26-12-14-6-4-3-5-7-14/h3-7,10-11,17-18H,2,8-9,12-13H2,1H3,(H,21,23)(H,22,24)/t17-,18+/m1/s1
InChIKeyPNNSNFPGFGZCIS-MSOLQXFVSA-N
MW356.42 g/mol
LogP2.04
Rot. Bonds6

About 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide

2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide (PubChem CID 90647374) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide
PubChem CID90647374
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide
SMILESCCc1cc(C(=O)N[C@@H]2COCC[C@@H]2OCc2ccccc2)cc(=O)[nH]1
InChIInChI=1S/C20H24N2O4/c1-2-16-10-15(11-19(23)21-16)20(24)22-17-13-25-9-8-18(17)26-12-14-6-4-3-5-7-14/h3-7,10-11,17-18H,2,8-9,12-13H2,1H3,(H,21,23)(H,22,24)/t17-,18+/m1/s1
InChIKeyPNNSNFPGFGZCIS-MSOLQXFVSA-N
XLogP2.04
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-(2-ethoxy-2-phenylethyl)-1,5-dimethyl-N-[2-(methylamino)-2-oxoethyl]-6-oxopyridine-3-carboxamide
CID 164609717
N-(1-methyl-6-oxo-3-pyridinyl)-4-phenylmethoxypiperidine-1-carboxamide
CID 75462276
2-oxo-N-[3-(1-phenylethoxy)propyl]-1H-pyridine-3-carboxamide
CID 42883825
5-(4-((benzyloxy)methyl)piperidine-1-carbonyl)pyridin-2(1H)-one
CID 49677763
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-phenylmorpholine-4-carboxamide
CID 71893521
1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-(2-methoxy-2-phenylethyl)urea
CID 72050246
1-Methyl-4-(2-phenylmorpholine-4-carbonyl)pyridin-2-one
CID 118740646
5-(benzyloxy)-N-isopropyl-4-oxo-4H-pyran-2-carboxamide
CID 42226901
benzyl N-[(E,1S)-1-isobutyl-4-morpholino-4-oxo-but-2-enyl]carbamate
CID 71598137
N-[cis-4-(benzyloxy)tetrahydro-2H-pyran-3-yl]-2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)acetamide
CID 90650989
N-[cis-4-(benzyloxy)tetrahydro-2H-pyran-3-yl]-3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)propanamide
CID 90653472
N-(isochroman-3-ylmethyl)-N-methyl-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 91626554

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide?
The IUPAC name of 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide (CID 90647374) is 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide is CCc1cc(C(=O)N[C@@H]2COCC[C@@H]2OCc2ccccc2)cc(=O)[nH]1.
What is the InChIKey of 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide?
The InChIKey is PNNSNFPGFGZCIS-MSOLQXFVSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-2-16-10-15(11-19(23)21-16)20(24)22-17-13-25-9-8-18(17)26-12-14-6-4-3-5-7-14/h3-7,10-11,17-18H,2,8-9,12-13H2,1H3,(H,21,23)(H,22,24)/t17-,18+/m1/s1.
What are the key properties of 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide?
2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide has a molecular weight of 356.42 g/mol, XLogP of 2.04, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-oxo-N-[(3R,4S)-4-phenylmethoxyoxan-3-yl]-1H-pyridine-4-carboxamide is sourced from PubChem (CID 90647374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).