4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine

C13H17F6N5O — CID 3273428

IUPAC4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESCN(C)c1nc(OC(C(F)(F)F)C(F)(F)F)nc(N2CCCCC2)n1
InChIInChI=1S/C13H17F6N5O/c1-23(2)9-20-10(24-6-4-3-5-7-24)22-11(21-9)25-8(12(14,15)16)13(17,18)19/h8H,3-7H2,1-2H3
InChIKeySNVVLWKECZYTBG-UHFFFAOYSA-N
MW373.30 g/mol
LogP2.80
Rot. Bonds4

About 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine

4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 3273428) has the molecular formula C13H17F6N5O and a molecular weight of 373.30 g/mol. Its IUPAC name is 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
PubChem CID3273428
Molecular FormulaC13H17F6N5O
Molecular Weight373.30 g/mol
Exact Mass373.13
IUPAC Name4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESCN(C)c1nc(OC(C(F)(F)F)C(F)(F)F)nc(N2CCCCC2)n1
InChIInChI=1S/C13H17F6N5O/c1-23(2)9-20-10(24-6-4-3-5-7-24)22-11(21-9)25-8(12(14,15)16)13(17,18)19/h8H,3-7H2,1-2H3
InChIKeySNVVLWKECZYTBG-UHFFFAOYSA-N
XLogP2.80
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.30
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine (CID 3273428) is 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine is CN(C)c1nc(OC(C(F)(F)F)C(F)(F)F)nc(N2CCCCC2)n1.
What is the InChIKey of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is SNVVLWKECZYTBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F6N5O/c1-23(2)9-20-10(24-6-4-3-5-7-24)22-11(21-9)25-8(12(14,15)16)13(17,18)19/h8H,3-7H2,1-2H3.
What are the key properties of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine?
4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 373.30 g/mol, XLogP of 2.80, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 3273428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).