3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine

C15H11Cl2N3 — CID 102753713

IUPAC3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine
SMILESCNc1nc(-c2cccc3cccnc23)c(Cl)cc1Cl
InChIInChI=1S/C15H11Cl2N3/c1-18-15-12(17)8-11(16)14(20-15)10-6-2-4-9-5-3-7-19-13(9)10/h2-8H,1H3,(H,18,20)
InChIKeyMFAUARUNXKPNSP-UHFFFAOYSA-N
MW304.18 g/mol
LogP4.65
Rot. Bonds2

About 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine

3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine (PubChem CID 102753713) has the molecular formula C15H11Cl2N3 and a molecular weight of 304.18 g/mol. Its IUPAC name is 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine
PubChem CID102753713
Molecular FormulaC15H11Cl2N3
Molecular Weight304.18 g/mol
Exact Mass303.03
IUPAC Name3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine
SMILESCNc1nc(-c2cccc3cccnc23)c(Cl)cc1Cl
InChIInChI=1S/C15H11Cl2N3/c1-18-15-12(17)8-11(16)14(20-15)10-6-2-4-9-5-3-7-19-13(9)10/h2-8H,1H3,(H,18,20)
InChIKeyMFAUARUNXKPNSP-UHFFFAOYSA-N
XLogP4.65
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.18
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine (CID 102753713) is 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine is CNc1nc(-c2cccc3cccnc23)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine?
The InChIKey is MFAUARUNXKPNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3/c1-18-15-12(17)8-11(16)14(20-15)10-6-2-4-9-5-3-7-19-13(9)10/h2-8H,1H3,(H,18,20).
What are the key properties of 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine?
3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine has a molecular weight of 304.18 g/mol, XLogP of 4.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-methyl-6-quinolin-8-ylpyridin-2-amine is sourced from PubChem (CID 102753713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).