N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide

C19H25N5O2 — CID 46834249

IUPACN-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide
SMILESCCN(Cc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O)C(C)=O
InChIInChI=1S/C19H25N5O2/c1-5-23(12(2)25)10-15-22-16-17(24(15)11-19(3,4)26)13-8-6-7-9-14(13)21-18(16)20/h6-9,26H,5,10-11H2,1-4H3,(H2,20,21)
InChIKeyIAGKCWZVZKRGBW-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.31
Rot. Bonds5

About N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide

N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide (PubChem CID 46834249) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide.

Molecular Properties

Compound NameN-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide
PubChem CID46834249
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide
SMILESCCN(Cc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O)C(C)=O
InChIInChI=1S/C19H25N5O2/c1-5-23(12(2)25)10-15-22-16-17(24(15)11-19(3,4)26)13-8-6-7-9-14(13)21-18(16)20/h6-9,26H,5,10-11H2,1-4H3,(H2,20,21)
InChIKeyIAGKCWZVZKRGBW-UHFFFAOYSA-N
XLogP2.31
TPSA97.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

CID 57469
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CID 159603
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CID 44592366
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CID 56833311
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CID 117918742
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CID 52945312
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CID 21470208
CID 21470208
CID 52944297
CID 52944297
CID 816945
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CID 254365
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CID 873559
CID 873559

Frequently Asked Questions

What is the IUPAC name of N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide?
The IUPAC name of N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide (CID 46834249) is N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide.
What is the SMILES notation for N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide?
The canonical SMILES for N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide is CCN(Cc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O)C(C)=O.
What is the InChIKey of N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide?
The InChIKey is IAGKCWZVZKRGBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-5-23(12(2)25)10-15-22-16-17(24(15)11-19(3,4)26)13-8-6-7-9-14(13)21-18(16)20/h6-9,26H,5,10-11H2,1-4H3,(H2,20,21).
What are the key properties of N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide?
N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide has a molecular weight of 355.44 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-amino-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-2-yl]methyl]-N-ethylacetamide is sourced from PubChem (CID 46834249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).