6-N,6-N,2-triethylquinoline-4,6-diamine

C15H21N3 — CID 63180601

IUPAC6-N,6-N,2-triethylquinoline-4,6-diamine
SMILESCCc1cc(N)c2cc(N(CC)CC)ccc2n1
InChIInChI=1S/C15H21N3/c1-4-11-9-14(16)13-10-12(18(5-2)6-3)7-8-15(13)17-11/h7-10H,4-6H2,1-3H3,(H2,16,17)
InChIKeyKZTVLGTXMRLCMQ-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.23
Rot. Bonds4

About 6-N,6-N,2-triethylquinoline-4,6-diamine

6-N,6-N,2-triethylquinoline-4,6-diamine (PubChem CID 63180601) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 6-N,6-N,2-triethylquinoline-4,6-diamine.

Molecular Properties

Compound Name6-N,6-N,2-triethylquinoline-4,6-diamine
PubChem CID63180601
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name6-N,6-N,2-triethylquinoline-4,6-diamine
SMILESCCc1cc(N)c2cc(N(CC)CC)ccc2n1
InChIInChI=1S/C15H21N3/c1-4-11-9-14(16)13-10-12(18(5-2)6-3)7-8-15(13)17-11/h7-10H,4-6H2,1-3H3,(H2,16,17)
InChIKeyKZTVLGTXMRLCMQ-UHFFFAOYSA-N
XLogP3.23
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-N,6-N,2-triethylquinoline-4,6-diamine?
The IUPAC name of 6-N,6-N,2-triethylquinoline-4,6-diamine (CID 63180601) is 6-N,6-N,2-triethylquinoline-4,6-diamine.
What is the SMILES notation for 6-N,6-N,2-triethylquinoline-4,6-diamine?
The canonical SMILES for 6-N,6-N,2-triethylquinoline-4,6-diamine is CCc1cc(N)c2cc(N(CC)CC)ccc2n1.
What is the InChIKey of 6-N,6-N,2-triethylquinoline-4,6-diamine?
The InChIKey is KZTVLGTXMRLCMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-4-11-9-14(16)13-10-12(18(5-2)6-3)7-8-15(13)17-11/h7-10H,4-6H2,1-3H3,(H2,16,17).
What are the key properties of 6-N,6-N,2-triethylquinoline-4,6-diamine?
6-N,6-N,2-triethylquinoline-4,6-diamine has a molecular weight of 243.35 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,6-N,2-triethylquinoline-4,6-diamine is sourced from PubChem (CID 63180601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).