N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine

C17H25N3 — CID 82247605

IUPACN,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine
SMILESCNCCc1c(C)nc2c(C)cc(C)cc2c1N(C)C
InChIInChI=1S/C17H25N3/c1-11-9-12(2)16-15(10-11)17(20(5)6)14(7-8-18-4)13(3)19-16/h9-10,18H,7-8H2,1-6H3
InChIKeyUZSFQJVTERWEGQ-UHFFFAOYSA-N
MW271.41 g/mol
LogP2.99
Rot. Bonds4

About N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine

N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine (PubChem CID 82247605) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine.

Molecular Properties

Compound NameN,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine
PubChem CID82247605
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC NameN,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine
SMILESCNCCc1c(C)nc2c(C)cc(C)cc2c1N(C)C
InChIInChI=1S/C17H25N3/c1-11-9-12(2)16-15(10-11)17(20(5)6)14(7-8-18-4)13(3)19-16/h9-10,18H,7-8H2,1-6H3
InChIKeyUZSFQJVTERWEGQ-UHFFFAOYSA-N
XLogP2.99
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine?
The IUPAC name of N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine (CID 82247605) is N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine.
What is the SMILES notation for N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine?
The canonical SMILES for N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine is CNCCc1c(C)nc2c(C)cc(C)cc2c1N(C)C.
What is the InChIKey of N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine?
The InChIKey is UZSFQJVTERWEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-11-9-12(2)16-15(10-11)17(20(5)6)14(7-8-18-4)13(3)19-16/h9-10,18H,7-8H2,1-6H3.
What are the key properties of N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine?
N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine has a molecular weight of 271.41 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,6,8-pentamethyl-3-[2-(methylamino)ethyl]quinolin-4-amine is sourced from PubChem (CID 82247605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).