2-N,2-N-diethylquinoline-2,8-diamine

C13H17N3 — CID 105469074

IUPAC2-N,2-N-diethylquinoline-2,8-diamine
SMILESCCN(CC)c1ccc2cccc(N)c2n1
InChIInChI=1S/C13H17N3/c1-3-16(4-2)12-9-8-10-6-5-7-11(14)13(10)15-12/h5-9H,3-4,14H2,1-2H3
InChIKeyGRTLXCSMCGLNAR-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.66
Rot. Bonds3

About 2-N,2-N-diethylquinoline-2,8-diamine

2-N,2-N-diethylquinoline-2,8-diamine (PubChem CID 105469074) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-N,2-N-diethylquinoline-2,8-diamine.

Molecular Properties

Compound Name2-N,2-N-diethylquinoline-2,8-diamine
PubChem CID105469074
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name2-N,2-N-diethylquinoline-2,8-diamine
SMILESCCN(CC)c1ccc2cccc(N)c2n1
InChIInChI=1S/C13H17N3/c1-3-16(4-2)12-9-8-10-6-5-7-11(14)13(10)15-12/h5-9H,3-4,14H2,1-2H3
InChIKeyGRTLXCSMCGLNAR-UHFFFAOYSA-N
XLogP2.66
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine
CID 60875708
2-(aminomethyl)quinolin-8-amine
CID 11715256
6-[6-[6-(diethylamino)-2-pyridinyl]-2-pyridinyl]-N,N-diethylpyridin-2-amine
CID 102213436
2-tert-butylquinolin-8-amine
CID 119094982
2-[(4-amino-1,3-benzoxazol-2-yl)-ethylamino]acetamide
CID 103101103
6-(2-amino-5-methylphenyl)-N,N-diethylpyridin-2-amine
CID 102170253
N'-(8-fluoroquinolin-2-yl)-N'-methylethane-1,2-diamine
CID 83837097
N-benzyl-2-[2-(diethylamino)quinolin-8-yl]oxyacetamide
CID 162675843
6-(diethylamino)pyridine-2-carbothioamide
CID 64587426
ethane;quinolin-8-amine
CID 91158659
N,N-diethyl-6-methoxypyridin-2-amine
CID 118576477
2-(trifluoromethyl)quinolin-8-amine
CID 129451588

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethylquinoline-2,8-diamine?
The IUPAC name of 2-N,2-N-diethylquinoline-2,8-diamine (CID 105469074) is 2-N,2-N-diethylquinoline-2,8-diamine.
What is the SMILES notation for 2-N,2-N-diethylquinoline-2,8-diamine?
The canonical SMILES for 2-N,2-N-diethylquinoline-2,8-diamine is CCN(CC)c1ccc2cccc(N)c2n1.
What is the InChIKey of 2-N,2-N-diethylquinoline-2,8-diamine?
The InChIKey is GRTLXCSMCGLNAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-3-16(4-2)12-9-8-10-6-5-7-11(14)13(10)15-12/h5-9H,3-4,14H2,1-2H3.
What are the key properties of 2-N,2-N-diethylquinoline-2,8-diamine?
2-N,2-N-diethylquinoline-2,8-diamine has a molecular weight of 215.30 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethylquinoline-2,8-diamine is sourced from PubChem (CID 105469074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).