N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide

C14H22N4O — CID 154582448

IUPACN-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide
SMILESCCc1cnc(N2CCC(N(C)C(C)=O)CC2)nc1
InChIInChI=1S/C14H22N4O/c1-4-12-9-15-14(16-10-12)18-7-5-13(6-8-18)17(3)11(2)19/h9-10,13H,4-8H2,1-3H3
InChIKeyHBMGINSJNUIUDE-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.49
Rot. Bonds3

About N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide

N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide (PubChem CID 154582448) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide
PubChem CID154582448
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide
SMILESCCc1cnc(N2CCC(N(C)C(C)=O)CC2)nc1
InChIInChI=1S/C14H22N4O/c1-4-12-9-15-14(16-10-12)18-7-5-13(6-8-18)17(3)11(2)19/h9-10,13H,4-8H2,1-3H3
InChIKeyHBMGINSJNUIUDE-UHFFFAOYSA-N
XLogP1.49
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanone
CID 58567804
5-ethyl-2-(4-propan-2-ylpiperidin-1-yl)pyrimidine;propane
CID 145380179
[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 166600805
(1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol
CID 66696107
5-ethyl-2-[4-[(1S)-1-methoxyethyl]piperidin-1-yl]pyrimidine
CID 131998372
N-cyclopropyl-2-(6-ethoxy-3-pyridinyl)-N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]pyrimidine-5-carboxamide
CID 86686159
N-(4-ethylphenyl)-2-(4-methylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 109250918
2-[4-(3,3-dimethylbutan-2-yl)piperidin-1-yl]-5-ethylpyrimidine
CID 131998942
8-(5-ethylpyrimidin-2-yl)-N,N-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 131649217
1-[4-[3-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]propoxy]-2,6-difluorophenyl]ethanone
CID 147226565
2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylethanamine
CID 116976316
(7aR)-2-(5-ethylpyrimidin-2-yl)-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine
CID 66837618

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide?
The IUPAC name of N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide (CID 154582448) is N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide.
What is the SMILES notation for N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide?
The canonical SMILES for N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide is CCc1cnc(N2CCC(N(C)C(C)=O)CC2)nc1.
What is the InChIKey of N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide?
The InChIKey is HBMGINSJNUIUDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-4-12-9-15-14(16-10-12)18-7-5-13(6-8-18)17(3)11(2)19/h9-10,13H,4-8H2,1-3H3.
What are the key properties of N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide?
N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide has a molecular weight of 262.36 g/mol, XLogP of 1.49, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide is sourced from PubChem (CID 154582448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).