N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine

C18H24N2 — CID 18681645

IUPACN-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine
SMILESC=C(c1c(C)c(C)nc2ccccc12)N(C)C(C)(C)C
InChIInChI=1S/C18H24N2/c1-12-13(2)19-16-11-9-8-10-15(16)17(12)14(3)20(7)18(4,5)6/h8-11H,3H2,1-2,4-7H3
InChIKeyUPJVHCQJQVHHJI-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.55
Rot. Bonds2

About N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine

N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine (PubChem CID 18681645) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine.

Molecular Properties

Compound NameN-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine
PubChem CID18681645
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine
SMILESC=C(c1c(C)c(C)nc2ccccc12)N(C)C(C)(C)C
InChIInChI=1S/C18H24N2/c1-12-13(2)19-16-11-9-8-10-15(16)17(12)14(3)20(7)18(4,5)6/h8-11H,3H2,1-2,4-7H3
InChIKeyUPJVHCQJQVHHJI-UHFFFAOYSA-N
XLogP4.55
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine?
The IUPAC name of N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine (CID 18681645) is N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine.
What is the SMILES notation for N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine?
The canonical SMILES for N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine is C=C(c1c(C)c(C)nc2ccccc12)N(C)C(C)(C)C.
What is the InChIKey of N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine?
The InChIKey is UPJVHCQJQVHHJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-12-13(2)19-16-11-9-8-10-15(16)17(12)14(3)20(7)18(4,5)6/h8-11H,3H2,1-2,4-7H3.
What are the key properties of N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine?
N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine has a molecular weight of 268.40 g/mol, XLogP of 4.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,3-dimethylquinolin-4-yl)ethenyl]-N,2-dimethylpropan-2-amine is sourced from PubChem (CID 18681645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).