N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide

C23H24N4O2 — CID 55676948

IUPACN-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide
SMILESCC1CC(C)CN(C(=O)c2ccccc2NC(=O)c2cnc3ccccc3n2)C1
InChIInChI=1S/C23H24N4O2/c1-15-11-16(2)14-27(13-15)23(29)17-7-3-4-8-18(17)26-22(28)21-12-24-19-9-5-6-10-20(19)25-21/h3-10,12,15-16H,11,13-14H2,1-2H3,(H,26,28)
InChIKeyNQSIIINELUATKN-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.00
Rot. Bonds3

About N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide

N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide (PubChem CID 55676948) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide
PubChem CID55676948
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide
SMILESCC1CC(C)CN(C(=O)c2ccccc2NC(=O)c2cnc3ccccc3n2)C1
InChIInChI=1S/C23H24N4O2/c1-15-11-16(2)14-27(13-15)23(29)17-7-3-4-8-18(17)26-22(28)21-12-24-19-9-5-6-10-20(19)25-21/h3-10,12,15-16H,11,13-14H2,1-2H3,(H,26,28)
InChIKeyNQSIIINELUATKN-UHFFFAOYSA-N
XLogP4.00
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(piperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide
CID 17420584
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-6-methylpyridine-2-carboxamide
CID 46442735
5-bromo-N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]pyridine-3-carboxamide
CID 46437154
2-(2-aminoethyl)-N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 120621704
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 43048910
4-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]benzamide
CID 46442929
N-[2-(4-methylpiperazine-1-carbonyl)phenyl]quinoline-2-carboxamide
CID 30336602
N-[2-[(3R,5S)-3,5-dimethylpiperidine-1-carbonyl]phenyl]-3,4-dihydro-2H-pyran-5-carboxamide
CID 95156642
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-3-methylsulfanylimidazo[1,5-a]pyridine-1-carboxamide
CID 60563674
N-(2-bromophenyl)quinoxaline-2-carboxamide
CID 17429565
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]-2-methylsulfanylpropanamide
CID 60547227
N-[2-[2-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]anilino]-2-oxoethyl]-2-phenylacetamide
CID 51942969

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide?
The IUPAC name of N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide (CID 55676948) is N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide.
What is the SMILES notation for N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide?
The canonical SMILES for N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide is CC1CC(C)CN(C(=O)c2ccccc2NC(=O)c2cnc3ccccc3n2)C1.
What is the InChIKey of N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide?
The InChIKey is NQSIIINELUATKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-15-11-16(2)14-27(13-15)23(29)17-7-3-4-8-18(17)26-22(28)21-12-24-19-9-5-6-10-20(19)25-21/h3-10,12,15-16H,11,13-14H2,1-2H3,(H,26,28).
What are the key properties of N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide?
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide is sourced from PubChem (CID 55676948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).