N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

C14H20N4O2 — CID 104614609

IUPACN-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
SMILESCCCNC(=O)CNC(=O)c1ccc2c(c1)NCCN2
InChIInChI=1S/C14H20N4O2/c1-2-5-17-13(19)9-18-14(20)10-3-4-11-12(8-10)16-7-6-15-11/h3-4,8,15-16H,2,5-7,9H2,1H3,(H,17,19)(H,18,20)
InChIKeyRGYRYKHPKITEMH-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.78
Rot. Bonds5

About N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide (PubChem CID 104614609) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
PubChem CID104614609
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
SMILESCCCNC(=O)CNC(=O)c1ccc2c(c1)NCCN2
InChIInChI=1S/C14H20N4O2/c1-2-5-17-13(19)9-18-14(20)10-3-4-11-12(8-10)16-7-6-15-11/h3-4,8,15-16H,2,5-7,9H2,1H3,(H,17,19)(H,18,20)
InChIKeyRGYRYKHPKITEMH-UHFFFAOYSA-N
XLogP0.78
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylamino)-3-oxopropyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614869
N-[(4-methylcyclohexyl)methyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614995
3-fluoro-4-methoxy-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 9163422
2-(1,2,3,4-tetrahydroquinoxaline-6-carbonylamino)ethyl carbamate
CID 104615254
3-amino-4-bromo-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 61092685
N-[2-[cyclopropyl(methyl)amino]ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614971
N-benzyl-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614366
3,5-dimethyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 27256307
2-hydrazinyl-N-[2-oxo-2-(propylamino)ethyl]pyridine-4-carboxamide
CID 62243779
N-[1-(ethylamino)-1-oxopropan-2-yl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614761
3,5-dimethoxy-N-[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]benzamide
CID 18162820
4-cyclohexyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 18162781

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The IUPAC name of N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide (CID 104614609) is N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide.
What is the SMILES notation for N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The canonical SMILES for N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide is CCCNC(=O)CNC(=O)c1ccc2c(c1)NCCN2.
What is the InChIKey of N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The InChIKey is RGYRYKHPKITEMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-2-5-17-13(19)9-18-14(20)10-3-4-11-12(8-10)16-7-6-15-11/h3-4,8,15-16H,2,5-7,9H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 0.78, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(propylamino)ethyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide is sourced from PubChem (CID 104614609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).