4-N,7-N,7-N-trimethylquinoline-4,7-diamine

C12H15N3 — CID 14579986

IUPAC4-N,7-N,7-N-trimethylquinoline-4,7-diamine
SMILESCNc1ccnc2cc(N(C)C)ccc12
InChIInChI=1S/C12H15N3/c1-13-11-6-7-14-12-8-9(15(2)3)4-5-10(11)12/h4-8H,1-3H3,(H,13,14)
InChIKeyBMPFEDLQNLUMNA-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.34
Rot. Bonds2

About 4-N,7-N,7-N-trimethylquinoline-4,7-diamine

4-N,7-N,7-N-trimethylquinoline-4,7-diamine (PubChem CID 14579986) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-N,7-N,7-N-trimethylquinoline-4,7-diamine.

Molecular Properties

Compound Name4-N,7-N,7-N-trimethylquinoline-4,7-diamine
PubChem CID14579986
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name4-N,7-N,7-N-trimethylquinoline-4,7-diamine
SMILESCNc1ccnc2cc(N(C)C)ccc12
InChIInChI=1S/C12H15N3/c1-13-11-6-7-14-12-8-9(15(2)3)4-5-10(11)12/h4-8H,1-3H3,(H,13,14)
InChIKeyBMPFEDLQNLUMNA-UHFFFAOYSA-N
XLogP2.34
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-N,7-N,7-N-trimethylquinoline-4,7-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Chloroquine
CID 2719
4-Nitroquinoline 1-Oxide
CID 5955
Quinoline
CID 7047
Proflavine
CID 7099
6-Methylquinoline
CID 7059
Acridine Orange Base
CID 62344
3,6-Diamino-10-methylacridinium Chloride
CID 6842
4-Methylquinoline
CID 10285
5-Aminoisoquinoline
CID 70766
8-Methylquinoline
CID 11910
1,7-Phenanthroline
CID 67473
4-Amino-2-methylquinoline
CID 81116

Frequently Asked Questions

What is the IUPAC name of 4-N,7-N,7-N-trimethylquinoline-4,7-diamine?
The IUPAC name of 4-N,7-N,7-N-trimethylquinoline-4,7-diamine (CID 14579986) is 4-N,7-N,7-N-trimethylquinoline-4,7-diamine.
What is the SMILES notation for 4-N,7-N,7-N-trimethylquinoline-4,7-diamine?
The canonical SMILES for 4-N,7-N,7-N-trimethylquinoline-4,7-diamine is CNc1ccnc2cc(N(C)C)ccc12.
What is the InChIKey of 4-N,7-N,7-N-trimethylquinoline-4,7-diamine?
The InChIKey is BMPFEDLQNLUMNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-13-11-6-7-14-12-8-9(15(2)3)4-5-10(11)12/h4-8H,1-3H3,(H,13,14).
What are the key properties of 4-N,7-N,7-N-trimethylquinoline-4,7-diamine?
4-N,7-N,7-N-trimethylquinoline-4,7-diamine has a molecular weight of 201.27 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,7-N,7-N-trimethylquinoline-4,7-diamine is sourced from PubChem (CID 14579986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).