6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine

C16H23N3 — CID 63180558

IUPAC6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine
SMILESCCc1c(C)nc2ccc(N(CC)CC)cc2c1N
InChIInChI=1S/C16H23N3/c1-5-13-11(4)18-15-9-8-12(19(6-2)7-3)10-14(15)16(13)17/h8-10H,5-7H2,1-4H3,(H2,17,18)
InChIKeyOCVNJHJWOAPNGF-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.53
Rot. Bonds4

About 6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine

6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine (PubChem CID 63180558) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is 6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine.

Molecular Properties

Compound Name6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine
PubChem CID63180558
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC Name6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine
SMILESCCc1c(C)nc2ccc(N(CC)CC)cc2c1N
InChIInChI=1S/C16H23N3/c1-5-13-11(4)18-15-9-8-12(19(6-2)7-3)10-14(15)16(13)17/h8-10H,5-7H2,1-4H3,(H2,17,18)
InChIKeyOCVNJHJWOAPNGF-UHFFFAOYSA-N
XLogP3.53
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.53
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,3-triethyl-2-methylquinoline-4,6-diamine?
The IUPAC name of 6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine (CID 63180558) is 6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine.
What is the SMILES notation for 6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine?
The canonical SMILES for 6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine is CCc1c(C)nc2ccc(N(CC)CC)cc2c1N.
What is the InChIKey of 6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine?
The InChIKey is OCVNJHJWOAPNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-5-13-11(4)18-15-9-8-12(19(6-2)7-3)10-14(15)16(13)17/h8-10H,5-7H2,1-4H3,(H2,17,18).
What are the key properties of 6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine?
6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine has a molecular weight of 257.38 g/mol, XLogP of 3.53, 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,3-triethyl-2-methylquinoline-4,6-diamine is sourced from PubChem (CID 63180558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).