4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine

C14H12ClN5 — CID 81221970

IUPAC4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine
SMILESCN(C)c1nc(Cl)nc(-c2cccc3ncccc23)n1
InChIInChI=1S/C14H12ClN5/c1-20(2)14-18-12(17-13(15)19-14)10-5-3-7-11-9(10)6-4-8-16-11/h3-8H,1-2H3
InChIKeyNZEWFDMCJGFCHA-UHFFFAOYSA-N
MW285.74 g/mol
LogP2.81
Rot. Bonds2

About 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine

4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine (PubChem CID 81221970) has the molecular formula C14H12ClN5 and a molecular weight of 285.74 g/mol. Its IUPAC name is 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine
PubChem CID81221970
Molecular FormulaC14H12ClN5
Molecular Weight285.74 g/mol
Exact Mass285.08
IUPAC Name4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine
SMILESCN(C)c1nc(Cl)nc(-c2cccc3ncccc23)n1
InChIInChI=1S/C14H12ClN5/c1-20(2)14-18-12(17-13(15)19-14)10-5-3-7-11-9(10)6-4-8-16-11/h3-8H,1-2H3
InChIKeyNZEWFDMCJGFCHA-UHFFFAOYSA-N
XLogP2.81
TPSA54.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.74
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine 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

4-chloro-6-(3-methoxy-2-pyridinyl)-N,N-dimethyl-1,3,5-triazin-2-amine
CID 114054128
5-(5-methyl-1H-1,2,4-triazol-3-yl)quinoline
CID 62874875
4-chloro-6-(2-methoxy-3,4-dimethylphenyl)-N,N-dimethyl-1,3,5-triazin-2-amine
CID 103434427
5-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]quinoline
CID 122416200
5-[4-[3,5-di(phenanthren-9-yl)phenyl]-6-quinolin-5-yl-1,3,5-triazin-2-yl]quinoline
CID 146926587
5-(2,3-difluorophenyl)quinoline
CID 167880208
4-(4,6-dichloro-5-fluoropyrimidin-2-yl)quinoline
CID 80550830
4-pyrimidin-2-ylquinoline
CID 123157198
(2-quinolin-5-ylphenyl)methanol
CID 172649381
5-(3-methyl-5-quinolin-5-ylphenyl)quinoline
CID 144553990
N-methyl-4-quinolin-5-ylbenzamide
CID 119066467
5-(4-dibenzofuran-4-yl-6-phenanthren-4-yl-1,3,5-triazin-2-yl)quinoline
CID 169278618

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine (CID 81221970) is 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine is CN(C)c1nc(Cl)nc(-c2cccc3ncccc23)n1.
What is the InChIKey of 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine?
The InChIKey is NZEWFDMCJGFCHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN5/c1-20(2)14-18-12(17-13(15)19-14)10-5-3-7-11-9(10)6-4-8-16-11/h3-8H,1-2H3.
What are the key properties of 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine?
4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine has a molecular weight of 285.74 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N,N-dimethyl-6-quinolin-5-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 81221970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).