6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide

C21H26N2O4 — CID 97191298

IUPAC6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide
SMILESCCc1c(C)cc(C(=O)NC[C@@H]2COc3c(cccc3OC)C2)c(=O)n1C
InChIInChI=1S/C21H26N2O4/c1-5-17-13(2)9-16(21(25)23(17)3)20(24)22-11-14-10-15-7-6-8-18(26-4)19(15)27-12-14/h6-9,14H,5,10-12H2,1-4H3,(H,22,24)/t14-/m1/s1
InChIKeyZUMDMWSMDXOIEC-CQSZACIVSA-N
MW370.45 g/mol
LogP2.25
Rot. Bonds5

About 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide

6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide (PubChem CID 97191298) has the molecular formula C21H26N2O4 and a molecular weight of 370.45 g/mol. Its IUPAC name is 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide
PubChem CID97191298
Molecular FormulaC21H26N2O4
Molecular Weight370.45 g/mol
Exact Mass370.19
IUPAC Name6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide
SMILESCCc1c(C)cc(C(=O)NC[C@@H]2COc3c(cccc3OC)C2)c(=O)n1C
InChIInChI=1S/C21H26N2O4/c1-5-17-13(2)9-16(21(25)23(17)3)20(24)22-11-14-10-15-7-6-8-18(26-4)19(15)27-12-14/h6-9,14H,5,10-12H2,1-4H3,(H,22,24)/t14-/m1/s1
InChIKeyZUMDMWSMDXOIEC-CQSZACIVSA-N
XLogP2.25
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethyl-N-[[(3S)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide
CID 97191297
N-[(8-methoxy-3,4-dihydro-2H-chromen-3-yl)methyl]-5-methyl-1-propylpyrazole-4-carboxamide
CID 72868574
N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-3-methyl-1-propylpyrazole-4-carboxamide
CID 97208608
N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,3-dimethyl-2,6-dioxopyrimidine-4-carboxamide
CID 97198807
N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-2,6-dimethylpyridine-4-carboxamide
CID 99929986
4-chloro-2-fluoro-N-[(8-methoxy-3,4-dihydro-2H-chromen-3-yl)methyl]benzamide
CID 72849484
N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 97275977
N-[[(3S)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-5-(methoxymethyl)thiophene-2-carboxamide
CID 97275063
N-[(8-methoxy-3,4-dihydro-2H-chromen-3-yl)methyl]quinoline-5-carboxamide
CID 72926769
N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-3-(2-methyl-6-oxo-1-pyridinyl)propanamide
CID 97192487
N-[(8-methoxy-3,4-dihydro-2H-chromen-3-yl)methyl]piperidine-1-carboxamide
CID 72877803
N-[[(3S)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
CID 97194893

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide?
The IUPAC name of 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide (CID 97191298) is 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide is CCc1c(C)cc(C(=O)NC[C@@H]2COc3c(cccc3OC)C2)c(=O)n1C.
What is the InChIKey of 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide?
The InChIKey is ZUMDMWSMDXOIEC-CQSZACIVSA-N. The full InChI is InChI=1S/C21H26N2O4/c1-5-17-13(2)9-16(21(25)23(17)3)20(24)22-11-14-10-15-7-6-8-18(26-4)19(15)27-12-14/h6-9,14H,5,10-12H2,1-4H3,(H,22,24)/t14-/m1/s1.
What are the key properties of 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide?
6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide has a molecular weight of 370.45 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methyl]-1,5-dimethyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 97191298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).