N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide

C15H24N6O3 — CID 70705821

IUPACN-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide
SMILESO=C(NCCN1CCOC1=O)c1cn(CCC2CCCCN2)nn1
InChIInChI=1S/C15H24N6O3/c22-14(17-6-8-20-9-10-24-15(20)23)13-11-21(19-18-13)7-4-12-3-1-2-5-16-12/h11-12,16H,1-10H2,(H,17,22)
InChIKeyGAXNLVPWZGSKCA-UHFFFAOYSA-N
MW336.40 g/mol
LogP-0.01
Rot. Bonds7

About N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide

N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide (PubChem CID 70705821) has the molecular formula C15H24N6O3 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide
PubChem CID70705821
Molecular FormulaC15H24N6O3
Molecular Weight336.40 g/mol
Exact Mass336.19
IUPAC NameN-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide
SMILESO=C(NCCN1CCOC1=O)c1cn(CCC2CCCCN2)nn1
InChIInChI=1S/C15H24N6O3/c22-14(17-6-8-20-9-10-24-15(20)23)13-11-21(19-18-13)7-4-12-3-1-2-5-16-12/h11-12,16H,1-10H2,(H,17,22)
InChIKeyGAXNLVPWZGSKCA-UHFFFAOYSA-N
XLogP-0.01
TPSA101.38 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide?
The IUPAC name of N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide (CID 70705821) is N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide.
What is the SMILES notation for N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide?
The canonical SMILES for N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide is O=C(NCCN1CCOC1=O)c1cn(CCC2CCCCN2)nn1.
What is the InChIKey of N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide?
The InChIKey is GAXNLVPWZGSKCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6O3/c22-14(17-6-8-20-9-10-24-15(20)23)13-11-21(19-18-13)7-4-12-3-1-2-5-16-12/h11-12,16H,1-10H2,(H,17,22).
What are the key properties of N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide?
N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide has a molecular weight of 336.40 g/mol, XLogP of -0.01, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-1-(2-piperidin-2-ylethyl)triazole-4-carboxamide is sourced from PubChem (CID 70705821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).