8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine

C19H24N2O — CID 133377787

IUPAC8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine
SMILESCc1cccc2c(NC3CCOC4(CCCC4)C3)ccnc12
InChIInChI=1S/C19H24N2O/c1-14-5-4-6-16-17(7-11-20-18(14)16)21-15-8-12-22-19(13-15)9-2-3-10-19/h4-7,11,15H,2-3,8-10,12-13H2,1H3,(H,20,21)
InChIKeyLNVLGJBFLVWMBJ-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.45
Rot. Bonds2

About 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine

8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine (PubChem CID 133377787) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine.

Molecular Properties

Compound Name8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine
PubChem CID133377787
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine
SMILESCc1cccc2c(NC3CCOC4(CCCC4)C3)ccnc12
InChIInChI=1S/C19H24N2O/c1-14-5-4-6-16-17(7-11-20-18(14)16)21-15-8-12-22-19(13-15)9-2-3-10-19/h4-7,11,15H,2-3,8-10,12-13H2,1H3,(H,20,21)
InChIKeyLNVLGJBFLVWMBJ-UHFFFAOYSA-N
XLogP4.45
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine?
The IUPAC name of 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine (CID 133377787) is 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine.
What is the SMILES notation for 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine?
The canonical SMILES for 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine is Cc1cccc2c(NC3CCOC4(CCCC4)C3)ccnc12.
What is the InChIKey of 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine?
The InChIKey is LNVLGJBFLVWMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-14-5-4-6-16-17(7-11-20-18(14)16)21-15-8-12-22-19(13-15)9-2-3-10-19/h4-7,11,15H,2-3,8-10,12-13H2,1H3,(H,20,21).
What are the key properties of 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine?
8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine has a molecular weight of 296.41 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine is sourced from PubChem (CID 133377787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).