N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide

C23H25N3O — CID 30712262

IUPACN-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide
SMILESCCc1nc2ccc(C(=O)N(Cc3ccccc3)C3CC3)cc2nc1CC
InChIInChI=1S/C23H25N3O/c1-3-19-20(4-2)25-22-14-17(10-13-21(22)24-19)23(27)26(18-11-12-18)15-16-8-6-5-7-9-16/h5-10,13-14,18H,3-4,11-12,15H2,1-2H3
InChIKeyCJZZPXSAVZKRRL-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.56
Rot. Bonds6

About N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide

N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide (PubChem CID 30712262) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide
PubChem CID30712262
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC NameN-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide
SMILESCCc1nc2ccc(C(=O)N(Cc3ccccc3)C3CC3)cc2nc1CC
InChIInChI=1S/C23H25N3O/c1-3-19-20(4-2)25-22-14-17(10-13-21(22)24-19)23(27)26(18-11-12-18)15-16-8-6-5-7-9-16/h5-10,13-14,18H,3-4,11-12,15H2,1-2H3
InChIKeyCJZZPXSAVZKRRL-UHFFFAOYSA-N
XLogP4.56
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-benzyl-N-cyclopropylbenzamide
CID 43574369
4-[[benzoyl(cyclopropyl)amino]methyl]-N-methylbenzamide
CID 33351912
N-benzyl-4-(bromomethyl)-N-cyclopropylbenzamide
CID 102850934
1-benzyl-1-cyclopropyl-3-ethylurea
CID 127578302
N-benzyl-N-cyclopropyl-6-methoxyquinoline-2-carboxamide
CID 38283237
N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide
CID 64592060
N-cyclopropyl-1-ethyl-N-[(4-ethylphenyl)methyl]benzotriazole-5-carboxamide
CID 86925513
N-benzyl-6-bromo-N-cyclopropylpyridine-2-carboxamide
CID 103874221
N-cyclopropyl-3-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 47011279
N-benzyl-N-cyclopropyl-4-ethoxy-3-nitrobenzamide
CID 38270776
N-benzyl-N-cyclopropyl-4-(methanesulfonamido)benzamide
CID 38253884
4-(2-amino-2-oxoethoxy)-N-benzyl-N-cyclopropyl-3-methoxybenzamide
CID 38252727

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide?
The IUPAC name of N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide (CID 30712262) is N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide.
What is the SMILES notation for N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide?
The canonical SMILES for N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide is CCc1nc2ccc(C(=O)N(Cc3ccccc3)C3CC3)cc2nc1CC.
What is the InChIKey of N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide?
The InChIKey is CJZZPXSAVZKRRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-3-19-20(4-2)25-22-14-17(10-13-21(22)24-19)23(27)26(18-11-12-18)15-16-8-6-5-7-9-16/h5-10,13-14,18H,3-4,11-12,15H2,1-2H3.
What are the key properties of N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide?
N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 4.56, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-cyclopropyl-2,3-diethylquinoxaline-6-carboxamide is sourced from PubChem (CID 30712262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).