2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine

C9H12Cl2N4O — CID 62869567

IUPAC2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine
SMILESCOC1CCN(c2nc(Cl)nc(Cl)n2)CC1
InChIInChI=1S/C9H12Cl2N4O/c1-16-6-2-4-15(5-3-6)9-13-7(10)12-8(11)14-9/h6H,2-5H2,1H3
InChIKeyZAUHRLVHUBFVJD-UHFFFAOYSA-N
MW263.13 g/mol
LogP1.79
Rot. Bonds2

About 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine

2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine (PubChem CID 62869567) has the molecular formula C9H12Cl2N4O and a molecular weight of 263.13 g/mol. Its IUPAC name is 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine
PubChem CID62869567
Molecular FormulaC9H12Cl2N4O
Molecular Weight263.13 g/mol
Exact Mass262.04
IUPAC Name2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine
SMILESCOC1CCN(c2nc(Cl)nc(Cl)n2)CC1
InChIInChI=1S/C9H12Cl2N4O/c1-16-6-2-4-15(5-3-6)9-13-7(10)12-8(11)14-9/h6H,2-5H2,1H3
InChIKeyZAUHRLVHUBFVJD-UHFFFAOYSA-N
XLogP1.79
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.13
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N,N-diethyl-6-(4-methoxypiperidin-1-yl)-1,3,5-triazin-2-amine
CID 62863161
4-[4-chloro-6-(3-methoxypyrrolidin-1-yl)-1,3,5-triazin-2-yl]morpholine
CID 103536614
1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine
CID 129011540
6-(4-methoxypiperidin-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80783413
2-chloro-4-(3,4-dimethoxypyrrolidin-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazine
CID 103536639
2-chloro-4-(4-methoxypiperidin-1-yl)-5-methylpyrimidine
CID 79075665
2,4-dichloro-6-(4-cyclopropylpiperazin-1-yl)-1,3,5-triazine
CID 62869573
1-[1-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)piperidin-4-yl]ethanamine
CID 63595725
2,3,5-trichloro-6-(4-methoxypiperidin-1-yl)pyridine
CID 102750334
3,5-dichloro-4-(4-methoxypiperidin-1-yl)pyridine
CID 174621595
1-(4,6-dichloro-1,3,5-triazin-2-yl)-3-methylpiperidin-4-ol
CID 114679663
2-[1-[4-chloro-6-(propylamino)-1,3,5-triazin-2-yl]piperidin-4-yl]oxyethanol
CID 82689356

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine (CID 62869567) is 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine is COC1CCN(c2nc(Cl)nc(Cl)n2)CC1.
What is the InChIKey of 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine?
The InChIKey is ZAUHRLVHUBFVJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12Cl2N4O/c1-16-6-2-4-15(5-3-6)9-13-7(10)12-8(11)14-9/h6H,2-5H2,1H3.
What are the key properties of 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine?
2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine has a molecular weight of 263.13 g/mol, XLogP of 1.79, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine is sourced from PubChem (CID 62869567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).