N,2-diethyl-1-quinolin-7-ylhexan-1-amine

C19H28N2 — CID 105021496

IUPACN,2-diethyl-1-quinolin-7-ylhexan-1-amine
SMILESCCCCC(CC)C(NCC)c1ccc2cccnc2c1
InChIInChI=1S/C19H28N2/c1-4-7-9-15(5-2)19(20-6-3)17-12-11-16-10-8-13-21-18(16)14-17/h8,10-15,19-20H,4-7,9H2,1-3H3
InChIKeyJDSYRWLMVHCFSL-UHFFFAOYSA-N
MW284.45 g/mol
LogP5.10
Rot. Bonds8

About N,2-diethyl-1-quinolin-7-ylhexan-1-amine

N,2-diethyl-1-quinolin-7-ylhexan-1-amine (PubChem CID 105021496) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is N,2-diethyl-1-quinolin-7-ylhexan-1-amine.

Molecular Properties

Compound NameN,2-diethyl-1-quinolin-7-ylhexan-1-amine
PubChem CID105021496
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC NameN,2-diethyl-1-quinolin-7-ylhexan-1-amine
SMILESCCCCC(CC)C(NCC)c1ccc2cccnc2c1
InChIInChI=1S/C19H28N2/c1-4-7-9-15(5-2)19(20-6-3)17-12-11-16-10-8-13-21-18(16)14-17/h8,10-15,19-20H,4-7,9H2,1-3H3
InChIKeyJDSYRWLMVHCFSL-UHFFFAOYSA-N
XLogP5.10
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.45
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
CID 81231185
N-ethyl-1-quinolin-7-ylethanamine
CID 81221005
N-ethyl-2-methylsulfonyl-1-quinolin-7-ylpropan-1-amine
CID 105021408
2-methyl-N-propyl-1-quinolin-7-ylpropan-1-amine
CID 81220696
N-ethyl-3-quinolin-7-ylbutan-2-amine
CID 81224003
2-methyl-1-quinolin-7-ylhexan-1-amine
CID 114246526
(1S)-1-quinolin-7-ylnonan-1-ol
CID 15658090
N-ethyl-2-propan-2-ylsulfanyl-1-quinolin-7-ylethanamine
CID 81231123
N-[(1-methylcyclopentyl)-quinolin-7-ylmethyl]ethanamine
CID 105021674
3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
CID 105172706
1-(3-ethoxyphenyl)-N,2-diethylhexan-1-amine
CID 105022228
N-[(4-methyl-2-pyridinyl)-quinolin-7-ylmethyl]ethanamine
CID 81228376

Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-1-quinolin-7-ylhexan-1-amine?
The IUPAC name of N,2-diethyl-1-quinolin-7-ylhexan-1-amine (CID 105021496) is N,2-diethyl-1-quinolin-7-ylhexan-1-amine.
What is the SMILES notation for N,2-diethyl-1-quinolin-7-ylhexan-1-amine?
The canonical SMILES for N,2-diethyl-1-quinolin-7-ylhexan-1-amine is CCCCC(CC)C(NCC)c1ccc2cccnc2c1.
What is the InChIKey of N,2-diethyl-1-quinolin-7-ylhexan-1-amine?
The InChIKey is JDSYRWLMVHCFSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2/c1-4-7-9-15(5-2)19(20-6-3)17-12-11-16-10-8-13-21-18(16)14-17/h8,10-15,19-20H,4-7,9H2,1-3H3.
What are the key properties of N,2-diethyl-1-quinolin-7-ylhexan-1-amine?
N,2-diethyl-1-quinolin-7-ylhexan-1-amine has a molecular weight of 284.45 g/mol, XLogP of 5.10, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-1-quinolin-7-ylhexan-1-amine is sourced from PubChem (CID 105021496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).