[1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol

C13H23N5O — CID 57067375

IUPAC[1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
SMILESCCN(CC)c1ncnc(N2CCCC(CO)C2)n1
InChIInChI=1S/C13H23N5O/c1-3-17(4-2)12-14-10-15-13(16-12)18-7-5-6-11(8-18)9-19/h10-11,19H,3-9H2,1-2H3
InChIKeyYJBHAXSQZCCLSK-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.93
Rot. Bonds5

About [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol

[1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol (PubChem CID 57067375) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
PubChem CID57067375
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name[1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
SMILESCCN(CC)c1ncnc(N2CCCC(CO)C2)n1
InChIInChI=1S/C13H23N5O/c1-3-17(4-2)12-14-10-15-13(16-12)18-7-5-6-11(8-18)9-19/h10-11,19H,3-9H2,1-2H3
InChIKeyYJBHAXSQZCCLSK-UHFFFAOYSA-N
XLogP0.93
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol?
The IUPAC name of [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol (CID 57067375) is [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol.
What is the SMILES notation for [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol?
The canonical SMILES for [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol is CCN(CC)c1ncnc(N2CCCC(CO)C2)n1.
What is the InChIKey of [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol?
The InChIKey is YJBHAXSQZCCLSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-3-17(4-2)12-14-10-15-13(16-12)18-7-5-6-11(8-18)9-19/h10-11,19H,3-9H2,1-2H3.
What are the key properties of [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol?
[1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol has a molecular weight of 265.36 g/mol, XLogP of 0.93, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol is sourced from PubChem (CID 57067375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).