N-(2-phenylethyl)quinoxaline-6-carboxamide

C17H15N3O — CID 858929

IUPACN-(2-phenylethyl)quinoxaline-6-carboxamide
SMILESO=C(NCCc1ccccc1)c1ccc2nccnc2c1
InChIInChI=1S/C17H15N3O/c21-17(20-9-8-13-4-2-1-3-5-13)14-6-7-15-16(12-14)19-11-10-18-15/h1-7,10-12H,8-9H2,(H,20,21)
InChIKeyOGKUHRAIEIGMMU-UHFFFAOYSA-N
MW277.33 g/mol
LogP2.60
Rot. Bonds4

About N-(2-phenylethyl)quinoxaline-6-carboxamide

N-(2-phenylethyl)quinoxaline-6-carboxamide (PubChem CID 858929) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-(2-phenylethyl)quinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-(2-phenylethyl)quinoxaline-6-carboxamide
PubChem CID858929
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-(2-phenylethyl)quinoxaline-6-carboxamide
SMILESO=C(NCCc1ccccc1)c1ccc2nccnc2c1
InChIInChI=1S/C17H15N3O/c21-17(20-9-8-13-4-2-1-3-5-13)14-6-7-15-16(12-14)19-11-10-18-15/h1-7,10-12H,8-9H2,(H,20,21)
InChIKeyOGKUHRAIEIGMMU-UHFFFAOYSA-N
XLogP2.60
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenylethyl)quinoline-6-carboxamide
CID 2823262
N-[2-[4-(dimethylamino)phenyl]ethyl]quinoxaline-6-carboxamide
CID 146083370
N-[2-[4-[(dimethylamino)methyl]phenyl]ethyl]quinoxaline-6-carboxamide
CID 166286953
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
N-[2-(2-methoxyphenyl)ethyl]quinoxaline-6-carboxamide
CID 110690530
N-(3-bromopropyl)quinoxaline-6-carboxamide
CID 62874705
3-N-benzyl-1-N-(2-phenylethyl)benzene-1,3-dicarboxamide
CID 109054092
N-(2-phenylethyl)-2-pyridin-2-yl-1,3-benzoxazole-6-carboxamide
CID 134798841
3-(2-phenylethylcarbamoyl)pyrazine-2-carboxylic acid
CID 1207738
2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide
CID 84580463
N-[3-(furan-2-yl)propyl]quinoxaline-6-carboxamide
CID 74240216
N-[(2-aminophenyl)methyl]quinoxaline-6-carboxamide
CID 62849872

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)quinoxaline-6-carboxamide?
The IUPAC name of N-(2-phenylethyl)quinoxaline-6-carboxamide (CID 858929) is N-(2-phenylethyl)quinoxaline-6-carboxamide.
What is the SMILES notation for N-(2-phenylethyl)quinoxaline-6-carboxamide?
The canonical SMILES for N-(2-phenylethyl)quinoxaline-6-carboxamide is O=C(NCCc1ccccc1)c1ccc2nccnc2c1.
What is the InChIKey of N-(2-phenylethyl)quinoxaline-6-carboxamide?
The InChIKey is OGKUHRAIEIGMMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c21-17(20-9-8-13-4-2-1-3-5-13)14-6-7-15-16(12-14)19-11-10-18-15/h1-7,10-12H,8-9H2,(H,20,21).
What are the key properties of N-(2-phenylethyl)quinoxaline-6-carboxamide?
N-(2-phenylethyl)quinoxaline-6-carboxamide has a molecular weight of 277.33 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)quinoxaline-6-carboxamide is sourced from PubChem (CID 858929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).