2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine

C18H28N2 — CID 170610698

IUPAC2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine
SMILESCCC1(C)Nc2c(C)cc(NC(C)C)cc2C(C)=C1C
InChIInChI=1S/C18H28N2/c1-8-18(7)14(6)13(5)16-10-15(19-11(2)3)9-12(4)17(16)20-18/h9-11,19-20H,8H2,1-7H3
InChIKeyDVHDTPFJLOJBTM-UHFFFAOYSA-N
MW272.44 g/mol
LogP5.20
Rot. Bonds3

About 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine

2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine (PubChem CID 170610698) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine.

Molecular Properties

Compound Name2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine
PubChem CID170610698
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine
SMILESCCC1(C)Nc2c(C)cc(NC(C)C)cc2C(C)=C1C
InChIInChI=1S/C18H28N2/c1-8-18(7)14(6)13(5)16-10-15(19-11(2)3)9-12(4)17(16)20-18/h9-11,19-20H,8H2,1-7H3
InChIKeyDVHDTPFJLOJBTM-UHFFFAOYSA-N
XLogP5.20
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.44
LogP ≤ 55.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine?
The IUPAC name of 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine (CID 170610698) is 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine.
What is the SMILES notation for 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine?
The canonical SMILES for 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine is CCC1(C)Nc2c(C)cc(NC(C)C)cc2C(C)=C1C.
What is the InChIKey of 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine?
The InChIKey is DVHDTPFJLOJBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-8-18(7)14(6)13(5)16-10-15(19-11(2)3)9-12(4)17(16)20-18/h9-11,19-20H,8H2,1-7H3.
What are the key properties of 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine?
2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine has a molecular weight of 272.44 g/mol, XLogP of 5.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2,3,4,8-tetramethyl-N-propan-2-yl-1H-quinolin-6-amine is sourced from PubChem (CID 170610698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).