1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine

C8H11Cl2N5 — CID 129011540

IUPAC1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine
SMILESNC1CCN(c2nc(Cl)nc(Cl)n2)CC1
InChIInChI=1S/C8H11Cl2N5/c9-6-12-7(10)14-8(13-6)15-3-1-5(11)2-4-15/h5H,1-4,11H2
InChIKeyYOJCYOZKPUBLNH-UHFFFAOYSA-N
MW248.12 g/mol
LogP1.11
Rot. Bonds1

About 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine

1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine (PubChem CID 129011540) has the molecular formula C8H11Cl2N5 and a molecular weight of 248.12 g/mol. Its IUPAC name is 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine
PubChem CID129011540
Molecular FormulaC8H11Cl2N5
Molecular Weight248.12 g/mol
Exact Mass247.04
IUPAC Name1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine
SMILESNC1CCN(c2nc(Cl)nc(Cl)n2)CC1
InChIInChI=1S/C8H11Cl2N5/c9-6-12-7(10)14-8(13-6)15-3-1-5(11)2-4-15/h5H,1-4,11H2
InChIKeyYOJCYOZKPUBLNH-UHFFFAOYSA-N
XLogP1.11
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.12
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine
CID 62869567
2,4-dichloro-6-(4-cyclopropylpiperazin-1-yl)-1,3,5-triazine
CID 62869573
[1-(4-amino-6-chloro-1,3,5-triazin-2-yl)piperidin-4-yl]methanol
CID 80757183
2-chloro-4-(4-propylpiperidin-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazine
CID 62864514
1-(4,6-dichloro-1,3,5-triazin-2-yl)-3-methylpiperidin-4-ol
CID 114679663
2-(4,6-dichloro-1,3,5-triazin-2-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 115561016
1-(2-chloro-5-ethyl-6-methylpyrimidin-4-yl)piperidin-4-amine
CID 95928585
1-[1-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)piperidin-4-yl]ethanamine
CID 63595725
4-chloro-N-ethyl-6-(4-ethylpiperidin-1-yl)-1,3,5-triazin-2-amine
CID 80796310
4-chloro-N-(cyclopropylmethyl)-N-methyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 62864587
2,4-dichloro-6-(4-propan-2-ylpiperazin-1-yl)-1,3,5-triazine
CID 62868716
4-(azocan-1-yl)-6-chloro-1,3,5-triazin-2-amine
CID 80764933

Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine?
The IUPAC name of 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine (CID 129011540) is 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine.
What is the SMILES notation for 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine?
The canonical SMILES for 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine is NC1CCN(c2nc(Cl)nc(Cl)n2)CC1.
What is the InChIKey of 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine?
The InChIKey is YOJCYOZKPUBLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11Cl2N5/c9-6-12-7(10)14-8(13-6)15-3-1-5(11)2-4-15/h5H,1-4,11H2.
What are the key properties of 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine?
1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine has a molecular weight of 248.12 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dichloro-1,3,5-triazin-2-yl)piperidin-4-amine is sourced from PubChem (CID 129011540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).