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

C14H25N5O2 — CID 106668991

IUPAC4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESCOC(C)(C)CCOc1nc(N)nc(N2CCCCC2)n1
InChIInChI=1S/C14H25N5O2/c1-14(2,20-3)7-10-21-13-17-11(15)16-12(18-13)19-8-5-4-6-9-19/h4-10H2,1-3H3,(H2,15,16,17,18)
InChIKeyIATYZRORAOBIDU-UHFFFAOYSA-N
MW295.39 g/mol
LogP1.64
Rot. Bonds6

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

4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 106668991) has the molecular formula C14H25N5O2 and a molecular weight of 295.39 g/mol. Its IUPAC name is 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine
PubChem CID106668991
Molecular FormulaC14H25N5O2
Molecular Weight295.39 g/mol
Exact Mass295.20
IUPAC Name4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine
SMILESCOC(C)(C)CCOc1nc(N)nc(N2CCCCC2)n1
InChIInChI=1S/C14H25N5O2/c1-14(2,20-3)7-10-21-13-17-11(15)16-12(18-13)19-8-5-4-6-9-19/h4-10H2,1-3H3,(H2,15,16,17,18)
InChIKeyIATYZRORAOBIDU-UHFFFAOYSA-N
XLogP1.64
TPSA86.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-N-(2-methoxy-2-methylpropyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 104767252
4-(2-butoxyethoxy)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80861399
[4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80923939
4-(3-methoxy-3-methylbutoxy)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 106669229
4-prop-2-enoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80867785
4-(cyclohexylmethoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80880804
4-piperidin-1-yl-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazin-2-amine
CID 80877379
4-(4,4-dimethylazepan-1-yl)-6-ethoxy-1,3,5-triazin-2-amine
CID 80842750
1-(4-amino-6-propoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-ol
CID 81108978
1-(4-chloro-6-propoxy-1,3,5-triazin-2-yl)azepane
CID 62869524
4-hexoxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80862100
4-ethoxy-6-(4-propan-2-ylazepan-1-yl)-1,3,5-triazin-2-amine
CID 80837736

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine (CID 106668991) is 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine is COC(C)(C)CCOc1nc(N)nc(N2CCCCC2)n1.
What is the InChIKey of 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is IATYZRORAOBIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O2/c1-14(2,20-3)7-10-21-13-17-11(15)16-12(18-13)19-8-5-4-6-9-19/h4-10H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine?
4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 295.39 g/mol, XLogP of 1.64, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 106668991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).