3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine

C15H14N4 — CID 104540323

IUPAC3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine
SMILESCc1ccc2cccc(Nc3cccnc3N)c2n1
InChIInChI=1S/C15H14N4/c1-10-7-8-11-4-2-5-12(14(11)18-10)19-13-6-3-9-17-15(13)16/h2-9,19H,1H3,(H2,16,17)
InChIKeyGRESKLBVPGTRPO-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.26
Rot. Bonds2

About 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine

3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine (PubChem CID 104540323) has the molecular formula C15H14N4 and a molecular weight of 250.30 g/mol. Its IUPAC name is 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine.

Molecular Properties

Compound Name3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine
PubChem CID104540323
Molecular FormulaC15H14N4
Molecular Weight250.30 g/mol
Exact Mass250.12
IUPAC Name3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine
SMILESCc1ccc2cccc(Nc3cccnc3N)c2n1
InChIInChI=1S/C15H14N4/c1-10-7-8-11-4-2-5-12(14(11)18-10)19-13-6-3-9-17-15(13)16/h2-9,19H,1H3,(H2,16,17)
InChIKeyGRESKLBVPGTRPO-UHFFFAOYSA-N
XLogP3.26
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methylquinolin-8-yl)hydrazine
CID 957615
2-fluoro-1-N-(2-methylquinolin-8-yl)benzene-1,4-diamine
CID 62953097
CID 66916636
CID 66916636
dichloroiron;2-methyl-1,10-phenanthroline
CID 175695507
6-N-(2-methylquinolin-8-yl)-4-N-propan-2-ylpyrimidine-4,5,6-triamine
CID 19135607
CID 172780914
CID 172780914
2-methyl-8-(sulfamoylamino)quinoline
CID 112573710
2-[(2-methylquinolin-8-yl)amino]benzoic acid
CID 63538689
4-N-(2-methylquinolin-8-yl)-6-pyridin-3-yloxypyrimidine-4,5-diamine
CID 19144947
6-methyl-2-N-quinolin-8-ylpyridine-2,5-diamine
CID 79021158
4-N-(5-methyl-2-pyridinyl)-6-N-(2-methylquinolin-8-yl)pyrimidine-4,5,6-triamine
CID 19144951
CID 6371660
CID 6371660

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine?
The IUPAC name of 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine (CID 104540323) is 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine.
What is the SMILES notation for 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine?
The canonical SMILES for 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine is Cc1ccc2cccc(Nc3cccnc3N)c2n1.
What is the InChIKey of 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine?
The InChIKey is GRESKLBVPGTRPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-10-7-8-11-4-2-5-12(14(11)18-10)19-13-6-3-9-17-15(13)16/h2-9,19H,1H3,(H2,16,17).
What are the key properties of 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine?
3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine has a molecular weight of 250.30 g/mol, XLogP of 3.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine is sourced from PubChem (CID 104540323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).