2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide

C20H16N6O — CID 176873283

IUPAC2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide
SMILESCc1cccc(CNC(=O)Cc2nc3c(cnc4ccc(C#N)cc43)[nH]2)n1
InChIInChI=1S/C20H16N6O/c1-12-3-2-4-14(24-12)10-23-19(27)8-18-25-17-11-22-16-6-5-13(9-21)7-15(16)20(17)26-18/h2-7,11H,8,10H2,1H3,(H,23,27)(H,25,26)
InChIKeyFVSLLQWAZZCIDJ-UHFFFAOYSA-N
MW356.39 g/mol
LogP2.55
Rot. Bonds4

About 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide

2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide (PubChem CID 176873283) has the molecular formula C20H16N6O and a molecular weight of 356.39 g/mol. Its IUPAC name is 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide
PubChem CID176873283
Molecular FormulaC20H16N6O
Molecular Weight356.39 g/mol
Exact Mass356.14
IUPAC Name2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide
SMILESCc1cccc(CNC(=O)Cc2nc3c(cnc4ccc(C#N)cc43)[nH]2)n1
InChIInChI=1S/C20H16N6O/c1-12-3-2-4-14(24-12)10-23-19(27)8-18-25-17-11-22-16-6-5-13(9-21)7-15(16)20(17)26-18/h2-7,11H,8,10H2,1H3,(H,23,27)(H,25,26)
InChIKeyFVSLLQWAZZCIDJ-UHFFFAOYSA-N
XLogP2.55
TPSA107.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide with MolForge

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Related Compounds

2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 176873022
2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 176873132
2-[(5-methyl-1,2-oxazol-3-yl)methyl]-3H-imidazo[4,5-c]quinoline-8-carbonitrile
CID 126666679
2-[(5-methylsulfonyl-2-pyridinyl)methyl]-3H-imidazo[4,5-c]quinoline-8-carbonitrile
CID 170582675
2-(8-cyclopropyl-3H-imidazo[4,5-c]quinolin-2-yl)-N-(cyclopropylmethyl)acetamide
CID 176873379
1-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-(cyclopropylmethyl)methanesulfonamide
CID 176873172
4-cyano-N-(3,5,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-1,3,6,8,11-pentaen-4-ylmethyl)benzamide
CID 135142712
3-cyano-N-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl]benzamide
CID 56744624
N-[(6-cyano-1H-benzimidazol-2-yl)methyl]acetamide
CID 124703638
2-[(6-methyl-2-pyridinyl)methylamino]pyridine-4-carbonitrile
CID 62307193
2-methyloxane;2-(1,2-oxazol-3-ylmethyl)-3H-imidazo[4,5-c]quinoline-8-carbonitrile
CID 145275567
N-[(4-cyanophenyl)methyl]-2-[1-(6-methyl-2-pyridinyl)-5-quinoxalin-6-ylpyrazol-3-yl]acetamide
CID 138595171

Frequently Asked Questions

What is the IUPAC name of 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide (CID 176873283) is 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide is Cc1cccc(CNC(=O)Cc2nc3c(cnc4ccc(C#N)cc43)[nH]2)n1.
What is the InChIKey of 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide?
The InChIKey is FVSLLQWAZZCIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6O/c1-12-3-2-4-14(24-12)10-23-19(27)8-18-25-17-11-22-16-6-5-13(9-21)7-15(16)20(17)26-18/h2-7,11H,8,10H2,1H3,(H,23,27)(H,25,26).
What are the key properties of 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide?
2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide has a molecular weight of 356.39 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-cyano-3H-imidazo[4,5-c]quinolin-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide is sourced from PubChem (CID 176873283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).