1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine

C15H26N4 — CID 70728061

IUPAC1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine
SMILESCc1ncnc(N2CCC(C(C)N(C)C)CC2)c1C
InChIInChI=1S/C15H26N4/c1-11-12(2)16-10-17-15(11)19-8-6-14(7-9-19)13(3)18(4)5/h10,13-14H,6-9H2,1-5H3
InChIKeyLSNMYMQGNVFQAP-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.26
Rot. Bonds3

About 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine

1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine (PubChem CID 70728061) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine
PubChem CID70728061
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine
SMILESCc1ncnc(N2CCC(C(C)N(C)C)CC2)c1C
InChIInChI=1S/C15H26N4/c1-11-12(2)16-10-17-15(11)19-8-6-14(7-9-19)13(3)18(4)5/h10,13-14H,6-9H2,1-5H3
InChIKeyLSNMYMQGNVFQAP-UHFFFAOYSA-N
XLogP2.26
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine?
The IUPAC name of 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine (CID 70728061) is 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine?
The canonical SMILES for 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine is Cc1ncnc(N2CCC(C(C)N(C)C)CC2)c1C.
What is the InChIKey of 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine?
The InChIKey is LSNMYMQGNVFQAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-11-12(2)16-10-17-15(11)19-8-6-14(7-9-19)13(3)18(4)5/h10,13-14H,6-9H2,1-5H3.
What are the key properties of 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine?
1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine has a molecular weight of 262.40 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 70728061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).