N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide

C20H24N4O4 — CID 135119979

IUPACN-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide
SMILESCN1CC(NC(=O)c2c(N3CCOCC3)noc2-c2ccccc2)CCC1=O
InChIInChI=1S/C20H24N4O4/c1-23-13-15(7-8-16(23)25)21-20(26)17-18(14-5-3-2-4-6-14)28-22-19(17)24-9-11-27-12-10-24/h2-6,15H,7-13H2,1H3,(H,21,26)
InChIKeyCSPUWVBLCSZDPQ-UHFFFAOYSA-N
MW384.44 g/mol
LogP1.53
Rot. Bonds4

About N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide

N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide (PubChem CID 135119979) has the molecular formula C20H24N4O4 and a molecular weight of 384.44 g/mol. Its IUPAC name is N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide
PubChem CID135119979
Molecular FormulaC20H24N4O4
Molecular Weight384.44 g/mol
Exact Mass384.18
IUPAC NameN-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide
SMILESCN1CC(NC(=O)c2c(N3CCOCC3)noc2-c2ccccc2)CCC1=O
InChIInChI=1S/C20H24N4O4/c1-23-13-15(7-8-16(23)25)21-20(26)17-18(14-5-3-2-4-6-14)28-22-19(17)24-9-11-27-12-10-24/h2-6,15H,7-13H2,1H3,(H,21,26)
InChIKeyCSPUWVBLCSZDPQ-UHFFFAOYSA-N
XLogP1.53
TPSA87.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide (CID 135119979) is N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide is CN1CC(NC(=O)c2c(N3CCOCC3)noc2-c2ccccc2)CCC1=O.
What is the InChIKey of N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide?
The InChIKey is CSPUWVBLCSZDPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O4/c1-23-13-15(7-8-16(23)25)21-20(26)17-18(14-5-3-2-4-6-14)28-22-19(17)24-9-11-27-12-10-24/h2-6,15H,7-13H2,1H3,(H,21,26).
What are the key properties of N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide?
N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxopiperidin-3-yl)-3-morpholin-4-yl-5-phenyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 135119979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).