1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine

C16H18N4O — CID 103964539

IUPAC1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine
SMILESCC1(Cn2c(N)nc3cnc4ccccc4c32)CCCO1
InChIInChI=1S/C16H18N4O/c1-16(7-4-8-21-16)10-20-14-11-5-2-3-6-12(11)18-9-13(14)19-15(20)17/h2-3,5-6,9H,4,7-8,10H2,1H3,(H2,17,19)
InChIKeyPYRFARSGLKHQQY-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.74
Rot. Bonds2

About 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine

1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine (PubChem CID 103964539) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine.

Molecular Properties

Compound Name1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine
PubChem CID103964539
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine
SMILESCC1(Cn2c(N)nc3cnc4ccccc4c32)CCCO1
InChIInChI=1S/C16H18N4O/c1-16(7-4-8-21-16)10-20-14-11-5-2-3-6-12(11)18-9-13(14)19-15(20)17/h2-3,5-6,9H,4,7-8,10H2,1H3,(H2,17,19)
InChIKeyPYRFARSGLKHQQY-UHFFFAOYSA-N
XLogP2.74
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-methylbutyl)imidazo[4,5-c]quinolin-2-amine
CID 103964359
1-pentylimidazo[4,5-c]quinolin-2-amine
CID 103964360
1-(2,2,2-trifluoroethyl)imidazo[4,5-c]quinolin-2-amine
CID 103964365
4-chloro-1-[(2-methyloxolan-2-yl)methyl]benzimidazol-2-amine
CID 113459060
1-(pyridin-3-ylmethyl)imidazo[4,5-c]quinolin-2-amine
CID 103964383
1-(3-ethylpentan-3-yl)imidazo[4,5-c]quinolin-2-amine
CID 103964530
3-N-[(2-methyloxolan-2-yl)methyl]quinoxaline-2,3-diamine
CID 102984701
2-(2-aminoimidazo[4,5-c]quinolin-1-yl)cyclohexan-1-ol
CID 103964484
1-[1-(dimethylamino)propan-2-yl]imidazo[4,5-c]quinolin-2-amine
CID 103964554
1-(1-methylpiperidin-4-yl)imidazo[4,5-c]quinolin-2-amine
CID 103964413
2-(ethoxymethyl)-1-[[1-(2-methylsulfonylethoxy)cyclobutyl]methyl]imidazo[4,5-c]quinoline
CID 67203636
2-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-1-(5-methylsulfanylpentyl)imidazo[4,5-c]quinoline
CID 67052471

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine?
The IUPAC name of 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine (CID 103964539) is 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine.
What is the SMILES notation for 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine?
The canonical SMILES for 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine is CC1(Cn2c(N)nc3cnc4ccccc4c32)CCCO1.
What is the InChIKey of 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine?
The InChIKey is PYRFARSGLKHQQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-16(7-4-8-21-16)10-20-14-11-5-2-3-6-12(11)18-9-13(14)19-15(20)17/h2-3,5-6,9H,4,7-8,10H2,1H3,(H2,17,19).
What are the key properties of 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine?
1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine has a molecular weight of 282.35 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methyloxolan-2-yl)methyl]imidazo[4,5-c]quinolin-2-amine is sourced from PubChem (CID 103964539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).