N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine

C17H24N2 — CID 63525945

IUPACN-ethyl-3,6-di(propan-2-yl)quinolin-2-amine
SMILESCCNc1nc2ccc(C(C)C)cc2cc1C(C)C
InChIInChI=1S/C17H24N2/c1-6-18-17-15(12(4)5)10-14-9-13(11(2)3)7-8-16(14)19-17/h7-12H,6H2,1-5H3,(H,18,19)
InChIKeyCFRLJAKVGJJATN-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.91
Rot. Bonds4

About N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine

N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine (PubChem CID 63525945) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine.

Molecular Properties

Compound NameN-ethyl-3,6-di(propan-2-yl)quinolin-2-amine
PubChem CID63525945
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC NameN-ethyl-3,6-di(propan-2-yl)quinolin-2-amine
SMILESCCNc1nc2ccc(C(C)C)cc2cc1C(C)C
InChIInChI=1S/C17H24N2/c1-6-18-17-15(12(4)5)10-14-9-13(11(2)3)7-8-16(14)19-17/h7-12H,6H2,1-5H3,(H,18,19)
InChIKeyCFRLJAKVGJJATN-UHFFFAOYSA-N
XLogP4.91
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine?
The IUPAC name of N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine (CID 63525945) is N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine.
What is the SMILES notation for N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine?
The canonical SMILES for N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine is CCNc1nc2ccc(C(C)C)cc2cc1C(C)C.
What is the InChIKey of N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine?
The InChIKey is CFRLJAKVGJJATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-6-18-17-15(12(4)5)10-14-9-13(11(2)3)7-8-16(14)19-17/h7-12H,6H2,1-5H3,(H,18,19).
What are the key properties of N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine?
N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine has a molecular weight of 256.39 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,6-di(propan-2-yl)quinolin-2-amine is sourced from PubChem (CID 63525945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).