N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

C16H24N4O — CID 114504320

IUPACN-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
SMILESCC1CN(C)CCC1NC(=O)c1ccc2c(c1)NCCN2
InChIInChI=1S/C16H24N4O/c1-11-10-20(2)8-5-13(11)19-16(21)12-3-4-14-15(9-12)18-7-6-17-14/h3-4,9,11,13,17-18H,5-8,10H2,1-2H3,(H,19,21)
InChIKeyFPDBCJFAVOIEPI-UHFFFAOYSA-N
MW288.40 g/mol
LogP1.59
Rot. Bonds2

About N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide (PubChem CID 114504320) has the molecular formula C16H24N4O and a molecular weight of 288.40 g/mol. Its IUPAC name is N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
PubChem CID114504320
Molecular FormulaC16H24N4O
Molecular Weight288.40 g/mol
Exact Mass288.20
IUPAC NameN-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
SMILESCC1CN(C)CCC1NC(=O)c1ccc2c(c1)NCCN2
InChIInChI=1S/C16H24N4O/c1-11-10-20(2)8-5-13(11)19-16(21)12-3-4-14-15(9-12)18-7-6-17-14/h3-4,9,11,13,17-18H,5-8,10H2,1-2H3,(H,19,21)
InChIKeyFPDBCJFAVOIEPI-UHFFFAOYSA-N
XLogP1.59
TPSA56.40 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 51.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3-dimethylpiperidin-4-yl)-4-sulfanylbenzamide
CID 107036333
3-bromo-N-(1,3-dimethylpiperidin-4-yl)-4-methylbenzamide
CID 113247797
N-[(1-methylpiperidin-4-yl)methyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614849
N-(1,3-dimethylpiperidin-4-yl)-3H-benzimidazole-5-carboxamide
CID 18723319
N-(3-ethyl-2-methylcyclopentyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104615105
N-(1,3-dimethylpiperidin-4-yl)-4-(propylamino)benzamide
CID 114505976
N-(1-methyl-6-oxopiperidin-3-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104615091
N-(1,3-dimethylpiperidin-4-yl)-3,5-difluoro-4-hydrazinylbenzamide
CID 114505992
N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614341
5-amino-N-(1,3-dimethylpiperidin-4-yl)-2,4-dimethylbenzamide
CID 102706008
N-(1,3-dimethylpiperidin-4-yl)-2,3-dihydroxybenzamide
CID 114504406
N-[(4-methylcyclohexyl)methyl]-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614995

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The IUPAC name of N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide (CID 114504320) is N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide.
What is the SMILES notation for N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The canonical SMILES for N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide is CC1CN(C)CCC1NC(=O)c1ccc2c(c1)NCCN2.
What is the InChIKey of N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The InChIKey is FPDBCJFAVOIEPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-11-10-20(2)8-5-13(11)19-16(21)12-3-4-14-15(9-12)18-7-6-17-14/h3-4,9,11,13,17-18H,5-8,10H2,1-2H3,(H,19,21).
What are the key properties of N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide has a molecular weight of 288.40 g/mol, XLogP of 1.59, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide is sourced from PubChem (CID 114504320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).