N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine

C18H26N2 — CID 104997465

IUPACN-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine
SMILESCCNC(Cc1ccnc2ccccc12)C(C)C(C)C
InChIInChI=1S/C18H26N2/c1-5-19-18(14(4)13(2)3)12-15-10-11-20-17-9-7-6-8-16(15)17/h6-11,13-14,18-19H,5,12H2,1-4H3
InChIKeyWUAKWGJLMLGBPF-UHFFFAOYSA-N
MW270.42 g/mol
LogP4.05
Rot. Bonds6

About N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine

N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine (PubChem CID 104997465) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine.

Molecular Properties

Compound NameN-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine
PubChem CID104997465
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC NameN-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine
SMILESCCNC(Cc1ccnc2ccccc12)C(C)C(C)C
InChIInChI=1S/C18H26N2/c1-5-19-18(14(4)13(2)3)12-15-10-11-20-17-9-7-6-8-16(15)17/h6-11,13-14,18-19H,5,12H2,1-4H3
InChIKeyWUAKWGJLMLGBPF-UHFFFAOYSA-N
XLogP4.05
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N-propyl-1-quinolin-4-ylpentan-2-amine
CID 104997448
4-(2-ethylbutyl)quinoline
CID 143495355
N-ethyl-1-(1-methylcyclopentyl)-2-quinolin-4-ylethanamine
CID 104997457
N-ethyl-1-pyrimidin-5-yl-2-quinolin-4-ylethanamine
CID 102923542
4-ethoxy-N-ethyl-1-quinolin-4-ylbutan-2-amine
CID 105159357
2,3-dimethyl-4-quinolin-4-ylbutan-1-amine
CID 81015009
(2S)-3-methyl-2-(quinolin-4-ylmethylamino)butan-1-ol
CID 79253789
N-ethyl-1-(5-methylfuran-2-yl)-2-quinolin-4-ylethanamine
CID 104997381
N-ethyl-3-methoxy-3-methyl-1-quinolin-4-ylpentan-2-amine
CID 116757907
N-ethyl-1-(2-methylpyrazol-3-yl)-2-quinolin-4-ylethanamine
CID 105159264
4-(2-chlorobutyl)quinoline
CID 63203241
(3-cyclopropyl-1-quinolin-4-ylbutan-2-yl)hydrazine
CID 105316345

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine?
The IUPAC name of N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine (CID 104997465) is N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine.
What is the SMILES notation for N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine?
The canonical SMILES for N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine is CCNC(Cc1ccnc2ccccc12)C(C)C(C)C.
What is the InChIKey of N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine?
The InChIKey is WUAKWGJLMLGBPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-5-19-18(14(4)13(2)3)12-15-10-11-20-17-9-7-6-8-16(15)17/h6-11,13-14,18-19H,5,12H2,1-4H3.
What are the key properties of N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine?
N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine has a molecular weight of 270.42 g/mol, XLogP of 4.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,4-dimethyl-1-quinolin-4-ylpentan-2-amine is sourced from PubChem (CID 104997465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).