1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide

C18H22N4O4 — CID 30940077

IUPAC1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)N2CCC(C(=O)Nc3cc(C)on3)CC2)cc1
InChIInChI=1S/C18H22N4O4/c1-12-11-16(21-26-12)20-17(23)13-7-9-22(10-8-13)18(24)19-14-3-5-15(25-2)6-4-14/h3-6,11,13H,7-10H2,1-2H3,(H,19,24)(H,20,21,23)
InChIKeyKKESGAKHKCFZGD-UHFFFAOYSA-N
MW358.40 g/mol
LogP2.87
Rot. Bonds4

About 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide

1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide (PubChem CID 30940077) has the molecular formula C18H22N4O4 and a molecular weight of 358.40 g/mol. Its IUPAC name is 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide
PubChem CID30940077
Molecular FormulaC18H22N4O4
Molecular Weight358.40 g/mol
Exact Mass358.16
IUPAC Name1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)N2CCC(C(=O)Nc3cc(C)on3)CC2)cc1
InChIInChI=1S/C18H22N4O4/c1-12-11-16(21-26-12)20-17(23)13-7-9-22(10-8-13)18(24)19-14-3-5-15(25-2)6-4-14/h3-6,11,13H,7-10H2,1-2H3,(H,19,24)(H,20,21,23)
InChIKeyKKESGAKHKCFZGD-UHFFFAOYSA-N
XLogP2.87
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(4-methoxyphenyl)acetyl]-N-(5-methyl-1,2-oxazol-3-yl)piperidine-4-carboxamide
CID 39700872
1-(7-methoxy-2-methylquinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)piperidine-4-carboxamide
CID 55519367
4-N-cyclohexyl-1-N-(4-methoxyphenyl)piperidine-1,4-dicarboxamide
CID 6486998
4-N-(4-methoxyphenyl)-1-N-propan-2-ylpiperidine-1,4-dicarboxamide
CID 46428723
1-methyl-N-(5-methyl-1,2-oxazol-3-yl)piperidine-4-carboxamide
CID 110693557
N-(5-methyl-1,2-oxazol-3-yl)-1-[4-(2-methylpropanoylamino)benzoyl]piperidine-4-carboxamide
CID 55608113
N-(4-methoxyphenyl)-1-(5-methyl-1,2-oxazole-3-carbonyl)azetidine-3-carboxamide
CID 90511441
1-N,1-N-dimethyl-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide
CID 47136046
N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(4-methylphenoxy)acetyl]piperidine-4-carboxamide
CID 39701615
1-(3,5-dichloro-4-methoxybenzoyl)-N-(5-methyl-1,2-oxazol-3-yl)piperidine-4-carboxamide
CID 55485465
1-(cyclobutanecarbonyl)-N-(4-methoxyphenyl)piperidine-4-carboxamide
CID 113007524
1-N-(4-methoxyphenyl)-4-N-[(1R,2R)-2-methylcyclohexyl]piperidine-1,4-dicarboxamide
CID 7435228

Frequently Asked Questions

What is the IUPAC name of 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide (CID 30940077) is 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide is COc1ccc(NC(=O)N2CCC(C(=O)Nc3cc(C)on3)CC2)cc1.
What is the InChIKey of 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide?
The InChIKey is KKESGAKHKCFZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O4/c1-12-11-16(21-26-12)20-17(23)13-7-9-22(10-8-13)18(24)19-14-3-5-15(25-2)6-4-14/h3-6,11,13H,7-10H2,1-2H3,(H,19,24)(H,20,21,23).
What are the key properties of 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide?
1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide has a molecular weight of 358.40 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(4-methoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 30940077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).