N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine

C12H12N2O2 — CID 84622210

IUPACN,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine
SMILESCNc1cc(C)c2cc3c(cc2n1)OCO3
InChIInChI=1S/C12H12N2O2/c1-7-3-12(13-2)14-9-5-11-10(4-8(7)9)15-6-16-11/h3-5H,6H2,1-2H3,(H,13,14)
InChIKeyCPFVBJIUNZAONF-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.31
Rot. Bonds1

About N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine

N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine (PubChem CID 84622210) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine.

Molecular Properties

Compound NameN,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine
PubChem CID84622210
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC NameN,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine
SMILESCNc1cc(C)c2cc3c(cc2n1)OCO3
InChIInChI=1S/C12H12N2O2/c1-7-3-12(13-2)14-9-5-11-10(4-8(7)9)15-6-16-11/h3-5H,6H2,1-2H3,(H,13,14)
InChIKeyCPFVBJIUNZAONF-UHFFFAOYSA-N
XLogP2.31
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-8-[(6-methyl-[1,3]dioxolo[4,5-g]quinazolin-8-yl)disulfanyl]-[1,3]dioxolo[4,5-g]quinazoline
CID 13085991
7-(methylamino)-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carbonitrile
CID 84629981
6-methyl-[1,3]dioxolo[4,5-g]quinazolin-8-amine
CID 12668716
4-(8-methyl-[1,3]dioxolo[4,5-g]quinolin-6-yl)benzonitrile
CID 30333496
N-methyl-3-(6-methyl-1,3-benzodioxol-5-yl)-1,2,4-triazin-5-amine
CID 116823971
4-(8-methyl-[1,3]dioxolo[4,5-g]quinolin-6-yl)benzonitrile;hydrochloride
CID 42997555
6,8-dimethyl-7-oxido-[1,3]dioxolo[4,5-g]quinazolin-7-ium
CID 102138218
N-(1,3-benzodioxol-5-ylmethyl)-7-chloro-4-methylquinolin-2-amine
CID 23931420
4-N-(1,3-benzodioxol-5-yl)-6-N,2-dimethylpyrimidine-4,6-diamine
CID 80759901
6-(4-ethoxyphenyl)-8-methyl-[1,3]dioxolo[4,5-g]quinoline;hydrochloride
CID 42997566
N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine
CID 62201799
N,4-dimethyl-6-propan-2-ylquinolin-2-amine
CID 84621948

Frequently Asked Questions

What is the IUPAC name of N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine?
The IUPAC name of N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine (CID 84622210) is N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine.
What is the SMILES notation for N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine?
The canonical SMILES for N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine is CNc1cc(C)c2cc3c(cc2n1)OCO3.
What is the InChIKey of N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine?
The InChIKey is CPFVBJIUNZAONF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-7-3-12(13-2)14-9-5-11-10(4-8(7)9)15-6-16-11/h3-5H,6H2,1-2H3,(H,13,14).
What are the key properties of N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine?
N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine has a molecular weight of 216.24 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,8-dimethyl-[1,3]dioxolo[4,5-g]quinolin-6-amine is sourced from PubChem (CID 84622210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).