N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide

C22H29NO4 — CID 14300032

IUPACN-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide
SMILESCCCc1oc(C)c(C)c(=O)c1C(=O)Nc1c(CC)cc(OC)cc1CC
InChIInChI=1S/C22H29NO4/c1-7-10-18-19(21(24)13(4)14(5)27-18)22(25)23-20-15(8-2)11-17(26-6)12-16(20)9-3/h11-12H,7-10H2,1-6H3,(H,23,25)
InChIKeyPEOGCYUUASEXDV-UHFFFAOYSA-N
MW371.48 g/mol
LogP4.59
Rot. Bonds7

About N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide

N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide (PubChem CID 14300032) has the molecular formula C22H29NO4 and a molecular weight of 371.48 g/mol. Its IUPAC name is N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide
PubChem CID14300032
Molecular FormulaC22H29NO4
Molecular Weight371.48 g/mol
Exact Mass371.21
IUPAC NameN-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide
SMILESCCCc1oc(C)c(C)c(=O)c1C(=O)Nc1c(CC)cc(OC)cc1CC
InChIInChI=1S/C22H29NO4/c1-7-10-18-19(21(24)13(4)14(5)27-18)22(25)23-20-15(8-2)11-17(26-6)12-16(20)9-3/h11-12H,7-10H2,1-6H3,(H,23,25)
InChIKeyPEOGCYUUASEXDV-UHFFFAOYSA-N
XLogP4.59
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-(2,6-diethyl-4-methoxyphenyl)-2-(methoxymethyl)-1,6-dimethyl-4-oxopyridine-3-carboxamide
CID 23040863
N-(2,6-diethyl-4-methylphenyl)-1,5,6-trimethyl-4-oxo-2-propylpyridine-3-carboxamide
CID 23040200
N-(2,6-diethylphenyl)-6-methyl-4-oxo-2-propylpyran-3-carboxamide
CID 14127185
N-(4-chloro-2,6-diethylphenyl)-4-oxo-2-propylchromene-3-carboxamide
CID 139794938
N-(2,6-diethyl-4-propan-2-ylphenyl)-1,5,6-trimethyl-4-oxo-2-propylpyridine-3-carboxamide
CID 23039980
N-(4-amino-2,6-diethylphenyl)-2-butyl-1,5,6-trimethyl-4-oxopyridine-3-carboxamide
CID 23040350
N-(2-ethylphenyl)-2,5,6-trimethyl-4-oxopyran-3-carboxamide
CID 14128614
5-bromo-N-(2,6-diethylphenyl)-2-(ethoxymethyl)-6-methyl-4-oxopyran-3-carboxamide
CID 19836506
N-(2,6-diethylphenyl)-2,5,6-trimethyl-4-oxo-1-pentylpyridine-3-carboxamide
CID 23037899
N-(4-bromo-2,6-diethylphenyl)-1-butyl-2-ethyl-5,6-dimethyl-4-oxopyridine-3-carboxamide
CID 23040615
4-chloro-N-(2,6-diethyl-4-methoxyphenyl)-2,6-dimethyl-1-oxido-5-prop-2-enylpyridin-1-ium-3-carboxamide
CID 22153064
2-butyl-8-chloro-N-(2,6-diethylphenyl)-4-oxochromene-3-carboxamide
CID 139794959

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide?
The IUPAC name of N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide (CID 14300032) is N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide.
What is the SMILES notation for N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide?
The canonical SMILES for N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide is CCCc1oc(C)c(C)c(=O)c1C(=O)Nc1c(CC)cc(OC)cc1CC.
What is the InChIKey of N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide?
The InChIKey is PEOGCYUUASEXDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29NO4/c1-7-10-18-19(21(24)13(4)14(5)27-18)22(25)23-20-15(8-2)11-17(26-6)12-16(20)9-3/h11-12H,7-10H2,1-6H3,(H,23,25).
What are the key properties of N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide?
N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide has a molecular weight of 371.48 g/mol, XLogP of 4.59, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethyl-4-methoxyphenyl)-5,6-dimethyl-4-oxo-2-propylpyran-3-carboxamide is sourced from PubChem (CID 14300032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).