4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine

C11H20N6O — CID 80793675

IUPAC4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(N)nc(N2CCC(N(C)C)CC2)n1
InChIInChI=1S/C11H20N6O/c1-16(2)8-4-6-17(7-5-8)10-13-9(12)14-11(15-10)18-3/h8H,4-7H2,1-3H3,(H2,12,13,14,15)
InChIKeyYMAIHXCWICVJPK-UHFFFAOYSA-N
MW252.32 g/mol
LogP-0.01
Rot. Bonds3

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

4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine (PubChem CID 80793675) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine
PubChem CID80793675
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(N)nc(N2CCC(N(C)C)CC2)n1
InChIInChI=1S/C11H20N6O/c1-16(2)8-4-6-17(7-5-8)10-13-9(12)14-11(15-10)18-3/h8H,4-7H2,1-3H3,(H2,12,13,14,15)
InChIKeyYMAIHXCWICVJPK-UHFFFAOYSA-N
XLogP-0.01
TPSA80.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-[3-(diethylamino)pyrrolidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine
CID 80827963
4-(4,4-dimethylpiperidin-1-yl)-6-methoxy-1,3,5-triazin-2-amine
CID 80823660
2,4-dimethoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazine
CID 141014855
4-methoxy-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1,3,5-triazin-2-amine
CID 80837205
4-[4-(dimethylamino)piperidin-1-yl]-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-amine
CID 80776233
4-(3,3-dimethylpyrrolidin-1-yl)-6-methoxy-1,3,5-triazin-2-amine
CID 80854590
6-(4-methoxypiperidin-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80783413
2-[4-(dimethylamino)piperidin-1-yl]-6,7-dimethoxyquinazolin-4-amine
CID 3031652
4-[4-[(dimethylamino)methyl]piperidin-1-yl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80784975
2-(4-amino-6-methoxy-1,3,5-triazin-2-yl)-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82862624
4-(2-cyclopentylpyrrolidin-1-yl)-6-methoxy-1,3,5-triazin-2-amine
CID 80820078
4-(4-amino-6-methoxy-1,3,5-triazin-2-yl)piperazin-2-one
CID 80763853

Frequently Asked Questions

What is the IUPAC name of 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine (CID 80793675) is 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine is COc1nc(N)nc(N2CCC(N(C)C)CC2)n1.
What is the InChIKey of 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine?
The InChIKey is YMAIHXCWICVJPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-16(2)8-4-6-17(7-5-8)10-13-9(12)14-11(15-10)18-3/h8H,4-7H2,1-3H3,(H2,12,13,14,15).
What are the key properties of 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine?
4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine has a molecular weight of 252.32 g/mol, XLogP of -0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(dimethylamino)piperidin-1-yl]-6-methoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80793675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).