2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine

C15H26N4 — CID 55219733

IUPAC2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine
SMILESCc1ccnc(N2CCCCC2CNC(C)(C)C)n1
InChIInChI=1S/C15H26N4/c1-12-8-9-16-14(18-12)19-10-6-5-7-13(19)11-17-15(2,3)4/h8-9,13,17H,5-7,10-11H2,1-4H3
InChIKeyVASRMYQWUWCSSN-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.53
Rot. Bonds3

About 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine

2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine (PubChem CID 55219733) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine
PubChem CID55219733
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine
SMILESCc1ccnc(N2CCCCC2CNC(C)(C)C)n1
InChIInChI=1S/C15H26N4/c1-12-8-9-16-14(18-12)19-10-6-5-7-13(19)11-17-15(2,3)4/h8-9,13,17H,5-7,10-11H2,1-4H3
InChIKeyVASRMYQWUWCSSN-UHFFFAOYSA-N
XLogP2.53
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine (CID 55219733) is 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine is Cc1ccnc(N2CCCCC2CNC(C)(C)C)n1.
What is the InChIKey of 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine?
The InChIKey is VASRMYQWUWCSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-12-8-9-16-14(18-12)19-10-6-5-7-13(19)11-17-15(2,3)4/h8-9,13,17H,5-7,10-11H2,1-4H3.
What are the key properties of 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine?
2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine has a molecular weight of 262.40 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-(4-methylpyrimidin-2-yl)piperidin-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 55219733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).