N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine

C15H26N4 — CID 55218834

IUPACN-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine
SMILESCc1cc(N2CCCCC2CNC(C)C)nc(C)n1
InChIInChI=1S/C15H26N4/c1-11(2)16-10-14-7-5-6-8-19(14)15-9-12(3)17-13(4)18-15/h9,11,14,16H,5-8,10H2,1-4H3
InChIKeyKJPRCVJRZUOUGM-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.45
Rot. Bonds4

About N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine

N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine (PubChem CID 55218834) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine
PubChem CID55218834
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC NameN-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine
SMILESCc1cc(N2CCCCC2CNC(C)C)nc(C)n1
InChIInChI=1S/C15H26N4/c1-11(2)16-10-14-7-5-6-8-19(14)15-9-12(3)17-13(4)18-15/h9,11,14,16H,5-8,10H2,1-4H3
InChIKeyKJPRCVJRZUOUGM-UHFFFAOYSA-N
XLogP2.45
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine (CID 55218834) is N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine is Cc1cc(N2CCCCC2CNC(C)C)nc(C)n1.
What is the InChIKey of N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine?
The InChIKey is KJPRCVJRZUOUGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-11(2)16-10-14-7-5-6-8-19(14)15-9-12(3)17-13(4)18-15/h9,11,14,16H,5-8,10H2,1-4H3.
What are the key properties of N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine?
N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine has a molecular weight of 262.40 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 55218834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).