N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide

C18H21N5O3 — CID 166269260

IUPACN-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
SMILESCN(CC1CN(c2ccccc2)C(=O)O1)C(=O)C1CCn2ncnc2C1
InChIInChI=1S/C18H21N5O3/c1-21(17(24)13-7-8-23-16(9-13)19-12-20-23)10-15-11-22(18(25)26-15)14-5-3-2-4-6-14/h2-6,12-13,15H,7-11H2,1H3
InChIKeyFNQCJMMEESZNEG-UHFFFAOYSA-N
MW355.40 g/mol
LogP1.32
Rot. Bonds4

About N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide

N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide (PubChem CID 166269260) has the molecular formula C18H21N5O3 and a molecular weight of 355.40 g/mol. Its IUPAC name is N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
PubChem CID166269260
Molecular FormulaC18H21N5O3
Molecular Weight355.40 g/mol
Exact Mass355.16
IUPAC NameN-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
SMILESCN(CC1CN(c2ccccc2)C(=O)O1)C(=O)C1CCn2ncnc2C1
InChIInChI=1S/C18H21N5O3/c1-21(17(24)13-7-8-23-16(9-13)19-12-20-23)10-15-11-22(18(25)26-15)14-5-3-2-4-6-14/h2-6,12-13,15H,7-11H2,1H3
InChIKeyFNQCJMMEESZNEG-UHFFFAOYSA-N
XLogP1.32
TPSA80.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.40
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide?
The IUPAC name of N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide (CID 166269260) is N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide.
What is the SMILES notation for N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide?
The canonical SMILES for N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide is CN(CC1CN(c2ccccc2)C(=O)O1)C(=O)C1CCn2ncnc2C1.
What is the InChIKey of N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide?
The InChIKey is FNQCJMMEESZNEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O3/c1-21(17(24)13-7-8-23-16(9-13)19-12-20-23)10-15-11-22(18(25)26-15)14-5-3-2-4-6-14/h2-6,12-13,15H,7-11H2,1H3.
What are the key properties of N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide?
N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide has a molecular weight of 355.40 g/mol, XLogP of 1.32, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide is sourced from PubChem (CID 166269260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).