N-(2,2-dimethyloxan-4-yl)quinolin-2-amine

C16H20N2O — CID 115563852

IUPACN-(2,2-dimethyloxan-4-yl)quinolin-2-amine
SMILESCC1(C)CC(Nc2ccc3ccccc3n2)CCO1
InChIInChI=1S/C16H20N2O/c1-16(2)11-13(9-10-19-16)17-15-8-7-12-5-3-4-6-14(12)18-15/h3-8,13H,9-11H2,1-2H3,(H,17,18)
InChIKeyHVLQGPYAFGFBAH-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.60
Rot. Bonds2

About N-(2,2-dimethyloxan-4-yl)quinolin-2-amine

N-(2,2-dimethyloxan-4-yl)quinolin-2-amine (PubChem CID 115563852) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)quinolin-2-amine.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)quinolin-2-amine
PubChem CID115563852
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-(2,2-dimethyloxan-4-yl)quinolin-2-amine
SMILESCC1(C)CC(Nc2ccc3ccccc3n2)CCO1
InChIInChI=1S/C16H20N2O/c1-16(2)11-13(9-10-19-16)17-15-8-7-12-5-3-4-6-14(12)18-15/h3-8,13H,9-11H2,1-2H3,(H,17,18)
InChIKeyHVLQGPYAFGFBAH-UHFFFAOYSA-N
XLogP3.60
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-dimethyloxan-4-yl)-6-methylpyridin-2-amine
CID 83028574
6-N-(2,2-dimethyloxan-4-yl)pyridine-2,6-diamine
CID 83040213
N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine
CID 103967142
N-(2,2-dimethyloxan-4-yl)-1,3-benzoxazol-2-amine
CID 115563724
6-[(2,2-dimethyloxan-4-yl)amino]pyridine-2-carbonitrile
CID 113336612
1-N-methyl-4-N-quinolin-2-ylcyclohexane-1,4-diamine
CID 23026816
4-N-(2,2-dimethyloxan-4-yl)pyrimidine-2,4-diamine
CID 83040106
4-N-(2,2-dimethyloxan-4-yl)-6-hydrazinylpyrimidine-2,4-diamine
CID 83039065
6-N-(2,2-dimethyloxan-4-yl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719095
N-(2-phenyloxan-4-yl)quinolin-2-amine
CID 133474130
2-N-(2,2-dimethyloxan-4-yl)pyrazine-2,5-diamine
CID 83040320
N-(2,2-dimethyloxan-4-yl)-5-nitropyridin-2-amine
CID 113336591

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)quinolin-2-amine?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)quinolin-2-amine (CID 115563852) is N-(2,2-dimethyloxan-4-yl)quinolin-2-amine.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)quinolin-2-amine?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)quinolin-2-amine is CC1(C)CC(Nc2ccc3ccccc3n2)CCO1.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)quinolin-2-amine?
The InChIKey is HVLQGPYAFGFBAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-16(2)11-13(9-10-19-16)17-15-8-7-12-5-3-4-6-14(12)18-15/h3-8,13H,9-11H2,1-2H3,(H,17,18).
What are the key properties of N-(2,2-dimethyloxan-4-yl)quinolin-2-amine?
N-(2,2-dimethyloxan-4-yl)quinolin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)quinolin-2-amine is sourced from PubChem (CID 115563852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).