N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide

C13H20N4O — CID 133305493

IUPACN-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESCC(=O)N(C)C1CCN(c2cc(C)ncn2)CC1
InChIInChI=1S/C13H20N4O/c1-10-8-13(15-9-14-10)17-6-4-12(5-7-17)16(3)11(2)18/h8-9,12H,4-7H2,1-3H3
InChIKeyFPNKHRUXJVEFSM-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.23
Rot. Bonds2

About N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide

N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide (PubChem CID 133305493) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide
PubChem CID133305493
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC NameN-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESCC(=O)N(C)C1CCN(c2cc(C)ncn2)CC1
InChIInChI=1S/C13H20N4O/c1-10-8-13(15-9-14-10)17-6-4-12(5-7-17)16(3)11(2)18/h8-9,12H,4-7H2,1-3H3
InChIKeyFPNKHRUXJVEFSM-UHFFFAOYSA-N
XLogP1.23
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-chloropiperidin-1-yl)-6-methylpyrimidine
CID 63388301
N-[1-(6-cyclopropylpyrimidin-4-yl)pyrrolidin-3-yl]-N-methylacetamide
CID 155974233
(3S)-N,N-dimethyl-1-(6-methylpyrimidin-4-yl)pyrrolidine-3-carboxamide
CID 95839551
(3R)-N,N-dimethyl-1-(6-methylpyrimidin-4-yl)pyrrolidine-3-carboxamide
CID 95839552
[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]methanol
CID 61225123
N-methyl-N-[4-[(6-methylpyrimidin-4-yl)amino]cyclohexyl]acetamide
CID 90245746
cyclohexyl-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 108755282
3-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]propanoic acid
CID 62218201
N-cyclobutyl-N-[(4S)-1-(6-methylpyrimidin-4-yl)azepan-4-yl]methanesulfonamide
CID 129342697
1-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]ethanone
CID 63846340
1-[1-(6-ethylpyrimidin-4-yl)piperidin-4-yl]-1,3,3-trimethylurea
CID 166603398
2-methyl-1-(6-methylpyrimidin-4-yl)pyrrolidine-3-carboxylic acid
CID 79371902

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The IUPAC name of N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide (CID 133305493) is N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The canonical SMILES for N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide is CC(=O)N(C)C1CCN(c2cc(C)ncn2)CC1.
What is the InChIKey of N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The InChIKey is FPNKHRUXJVEFSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-10-8-13(15-9-14-10)17-6-4-12(5-7-17)16(3)11(2)18/h8-9,12H,4-7H2,1-3H3.
What are the key properties of N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide?
N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.23, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(6-methylpyrimidin-4-yl)piperidin-4-yl]acetamide is sourced from PubChem (CID 133305493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).