8-(3-methylbutan-2-yloxy)quinolin-2-amine

C14H18N2O — CID 10466406

IUPAC8-(3-methylbutan-2-yloxy)quinolin-2-amine
SMILESCC(C)C(C)Oc1cccc2ccc(N)nc12
InChIInChI=1S/C14H18N2O/c1-9(2)10(3)17-12-6-4-5-11-7-8-13(15)16-14(11)12/h4-10H,1-3H3,(H2,15,16)
InChIKeyUQTSQIVXJFEZMJ-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.24
Rot. Bonds3

About 8-(3-methylbutan-2-yloxy)quinolin-2-amine

8-(3-methylbutan-2-yloxy)quinolin-2-amine (PubChem CID 10466406) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 8-(3-methylbutan-2-yloxy)quinolin-2-amine.

Molecular Properties

Compound Name8-(3-methylbutan-2-yloxy)quinolin-2-amine
PubChem CID10466406
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name8-(3-methylbutan-2-yloxy)quinolin-2-amine
SMILESCC(C)C(C)Oc1cccc2ccc(N)nc12
InChIInChI=1S/C14H18N2O/c1-9(2)10(3)17-12-6-4-5-11-7-8-13(15)16-14(11)12/h4-10H,1-3H3,(H2,15,16)
InChIKeyUQTSQIVXJFEZMJ-UHFFFAOYSA-N
XLogP3.24
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(3-methylbutan-2-yloxy)quinolin-2-amine?
The IUPAC name of 8-(3-methylbutan-2-yloxy)quinolin-2-amine (CID 10466406) is 8-(3-methylbutan-2-yloxy)quinolin-2-amine.
What is the SMILES notation for 8-(3-methylbutan-2-yloxy)quinolin-2-amine?
The canonical SMILES for 8-(3-methylbutan-2-yloxy)quinolin-2-amine is CC(C)C(C)Oc1cccc2ccc(N)nc12.
What is the InChIKey of 8-(3-methylbutan-2-yloxy)quinolin-2-amine?
The InChIKey is UQTSQIVXJFEZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-9(2)10(3)17-12-6-4-5-11-7-8-13(15)16-14(11)12/h4-10H,1-3H3,(H2,15,16).
What are the key properties of 8-(3-methylbutan-2-yloxy)quinolin-2-amine?
8-(3-methylbutan-2-yloxy)quinolin-2-amine has a molecular weight of 230.31 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-methylbutan-2-yloxy)quinolin-2-amine is sourced from PubChem (CID 10466406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).