N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide

C24H29N3O4 — CID 3815274

IUPACN-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(N3C(=O)OC(c4ccccc4)C3C)CC2)c(C)c1
InChIInChI=1S/C24H29N3O4/c1-16-15-20(30-3)9-10-21(16)25-23(28)26-13-11-19(12-14-26)27-17(2)22(31-24(27)29)18-7-5-4-6-8-18/h4-10,15,17,19,22H,11-14H2,1-3H3,(H,25,28)
InChIKeyBDEXTUWHKIWAII-UHFFFAOYSA-N
MW423.51 g/mol
LogP4.58
Rot. Bonds4

About N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide

N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide (PubChem CID 3815274) has the molecular formula C24H29N3O4 and a molecular weight of 423.51 g/mol. Its IUPAC name is N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide
PubChem CID3815274
Molecular FormulaC24H29N3O4
Molecular Weight423.51 g/mol
Exact Mass423.22
IUPAC NameN-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(N3C(=O)OC(c4ccccc4)C3C)CC2)c(C)c1
InChIInChI=1S/C24H29N3O4/c1-16-15-20(30-3)9-10-21(16)25-23(28)26-13-11-19(12-14-26)27-17(2)22(31-24(27)29)18-7-5-4-6-8-18/h4-10,15,17,19,22H,11-14H2,1-3H3,(H,25,28)
InChIKeyBDEXTUWHKIWAII-UHFFFAOYSA-N
XLogP4.58
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.51
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide with MolForge

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Related Compounds

4-methyl-5-phenyl-3-[1-(2,4,5-trifluoro-3-methoxybenzoyl)piperidin-4-yl]-1,3-oxazolidin-2-one
CID 3869157
1-[(4-methoxy-2-methylphenyl)carbamoyl]-4-methylpyrrolidine-3-carboxylic acid
CID 63721672
(3S)-3-amino-N-(4-methoxy-2-methylphenyl)piperidine-1-carboxamide
CID 125179914
(1R,5S)-8-hydroxy-N-(4-methoxy-2-methylphenyl)-3-azabicyclo[3.2.1]octane-3-carboxamide
CID 118789979
N-(4-methoxy-2-methylphenyl)-2,3-dimethylthiomorpholine-4-carboxamide
CID 71915900
3-[1-[3-(4,5-dimethoxy-2-nitrophenyl)prop-2-enoyl]piperidin-4-yl]-4-methyl-5-phenyl-1,3-oxazolidin-2-one
CID 5006640
N-(4-methoxy-2-methylphenyl)-4-[(1R,2R,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]tridecan-11-yl]piperidine-1-carboxamide
CID 110195265
4-methyl-3-[1-(5-nitrofuran-2-carbonyl)piperidin-4-yl]-5-phenyl-1,3-oxazolidin-2-one
CID 4992744
[2-[4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl] N,N-dimethylcarbamodithioate
CID 5004117
N-(5-chloro-2-methoxyphenyl)-4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidine-1-carboxamide
CID 74225372
N-(4-methoxy-2-methylphenyl)-4-[3-(3-methylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxamide
CID 71839667
4-(3-benzyl-2-oxoimidazolidin-1-yl)-N-(2,4-dimethoxyphenyl)piperidine-1-carboxamide
CID 53098611

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide?
The IUPAC name of N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide (CID 3815274) is N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide is COc1ccc(NC(=O)N2CCC(N3C(=O)OC(c4ccccc4)C3C)CC2)c(C)c1.
What is the InChIKey of N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide?
The InChIKey is BDEXTUWHKIWAII-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O4/c1-16-15-20(30-3)9-10-21(16)25-23(28)26-13-11-19(12-14-26)27-17(2)22(31-24(27)29)18-7-5-4-6-8-18/h4-10,15,17,19,22H,11-14H2,1-3H3,(H,25,28).
What are the key properties of N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide?
N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide has a molecular weight of 423.51 g/mol, XLogP of 4.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-methylphenyl)-4-(4-methyl-2-oxo-5-phenyl-1,3-oxazolidin-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 3815274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).