N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide

C11H16N6O3 — CID 79523656

IUPACN-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide
SMILESO=C(N[C@@H]1CONC1=O)c1cn(C2CCNCC2)nn1
InChIInChI=1S/C11H16N6O3/c18-10(13-9-6-20-15-11(9)19)8-5-17(16-14-8)7-1-3-12-4-2-7/h5,7,9,12H,1-4,6H2,(H,13,18)(H,15,19)/t9-/m1/s1
InChIKeyDYHBBGDVKWTXKG-SECBINFHSA-N
MW280.29 g/mol
LogP-1.64
Rot. Bonds3

About N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide

N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide (PubChem CID 79523656) has the molecular formula C11H16N6O3 and a molecular weight of 280.29 g/mol. Its IUPAC name is N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide.

Molecular Properties

Compound NameN-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide
PubChem CID79523656
Molecular FormulaC11H16N6O3
Molecular Weight280.29 g/mol
Exact Mass280.13
IUPAC NameN-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide
SMILESO=C(N[C@@H]1CONC1=O)c1cn(C2CCNCC2)nn1
InChIInChI=1S/C11H16N6O3/c18-10(13-9-6-20-15-11(9)19)8-5-17(16-14-8)7-1-3-12-4-2-7/h5,7,9,12H,1-4,6H2,(H,13,18)(H,15,19)/t9-/m1/s1
InChIKeyDYHBBGDVKWTXKG-SECBINFHSA-N
XLogP-1.64
TPSA110.17 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 5-1.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

1-(azetidin-3-yl)-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]triazole-4-carboxamide
CID 79523298
N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 63284768
1-piperidin-4-yl-N-(2,3,4,5-tetrahydro-1-benzoxepin-5-yl)triazole-4-carboxamide;hydrochloride
CID 119761004
N-(3-phenylcyclobutyl)-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119774767
N-[1-(4-methylphenyl)-2-oxopyrrolidin-3-yl]-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119802728
1-(azetidin-3-yl)-N-(2-oxopiperidin-3-yl)triazole-4-carboxamide
CID 79317007
N-(2-methylpropyl)-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119673779
N-[1-(2-methoxyphenyl)-2-oxopyrrolidin-3-yl]-1-piperidin-4-yltriazole-4-carboxamide
CID 119814008
N-(2-chlorophenyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 63282984
methyl 2-[(1-piperidin-4-yltriazole-4-carbonyl)amino]acetate
CID 63283122
1-piperidin-4-yl-N-prop-2-ynyltriazole-4-carboxamide
CID 63283381
N-(2-acetamidoethyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 63283255

Frequently Asked Questions

What is the IUPAC name of N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide?
The IUPAC name of N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide (CID 79523656) is N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide.
What is the SMILES notation for N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide?
The canonical SMILES for N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide is O=C(N[C@@H]1CONC1=O)c1cn(C2CCNCC2)nn1.
What is the InChIKey of N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide?
The InChIKey is DYHBBGDVKWTXKG-SECBINFHSA-N. The full InChI is InChI=1S/C11H16N6O3/c18-10(13-9-6-20-15-11(9)19)8-5-17(16-14-8)7-1-3-12-4-2-7/h5,7,9,12H,1-4,6H2,(H,13,18)(H,15,19)/t9-/m1/s1.
What are the key properties of N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide?
N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide has a molecular weight of 280.29 g/mol, XLogP of -1.64, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-1-piperidin-4-yltriazole-4-carboxamide is sourced from PubChem (CID 79523656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).