N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide

C14H15N5O — CID 21436043

IUPACN-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide
SMILESCCCc1nc2nc3ccccc3nc2n1C(=O)NC
InChIInChI=1S/C14H15N5O/c1-3-6-11-18-12-13(19(11)14(20)15-2)17-10-8-5-4-7-9(10)16-12/h4-5,7-8H,3,6H2,1-2H3,(H,15,20)
InChIKeyPLTFPWPUHCUSDH-UHFFFAOYSA-N
MW269.31 g/mol
LogP2.12
Rot. Bonds2

About N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide

N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide (PubChem CID 21436043) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide
PubChem CID21436043
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC NameN-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide
SMILESCCCc1nc2nc3ccccc3nc2n1C(=O)NC
InChIInChI=1S/C14H15N5O/c1-3-6-11-18-12-13(19(11)14(20)15-2)17-10-8-5-4-7-9(10)16-12/h4-5,7-8H,3,6H2,1-2H3,(H,15,20)
InChIKeyPLTFPWPUHCUSDH-UHFFFAOYSA-N
XLogP2.12
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-propylimidazo[4,5-b]quinoxalin-3-yl)ethanone
CID 21435974
3-methyl-2-pentylimidazo[4,5-b]quinoxaline
CID 69396576
3-(4-hydroxybutyl)-2-propylquinazolin-4-one
CID 59723833
2-amino-N-ethylbenzimidazole-1-carboxamide
CID 12526522
2-methyl-2-(methylamino)-3-(2-propylbenzimidazol-1-yl)propanoic acid
CID 115970892
(2S)-2-(2-propylbenzimidazol-1-yl)propanoic acid
CID 7424145
2-(2-propylbenzimidazol-1-yl)cyclobutane-1-carboxylic acid
CID 112632122
N-pentan-3-yl-2-(2-propylbenzimidazol-1-yl)acetamide
CID 115569298
3-benzyl-5-(hydroxymethyl)-2-propylimidazole-4-carboxylic acid
CID 139830374
4-(2-propylbenzimidazol-1-yl)butanoic acid
CID 46784588
methyl 2-(ethylamino)-3-(2-propylbenzimidazol-1-yl)propanoate
CID 115970954
2-(2-propylbenzimidazol-1-yl)cyclopentane-1-carboxylic acid
CID 115971173

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide?
The IUPAC name of N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide (CID 21436043) is N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide.
What is the SMILES notation for N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide?
The canonical SMILES for N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide is CCCc1nc2nc3ccccc3nc2n1C(=O)NC.
What is the InChIKey of N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide?
The InChIKey is PLTFPWPUHCUSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-3-6-11-18-12-13(19(11)14(20)15-2)17-10-8-5-4-7-9(10)16-12/h4-5,7-8H,3,6H2,1-2H3,(H,15,20).
What are the key properties of N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide?
N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide has a molecular weight of 269.31 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-propylimidazo[4,5-b]quinoxaline-3-carboxamide is sourced from PubChem (CID 21436043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).