2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide

C16H28N4O — CID 51599887

IUPAC2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide
SMILESCc1nn(C)c(C)c1CCNC(=O)C[C@H]1CCCCN1C
InChIInChI=1S/C16H28N4O/c1-12-15(13(2)20(4)18-12)8-9-17-16(21)11-14-7-5-6-10-19(14)3/h14H,5-11H2,1-4H3,(H,17,21)/t14-/m1/s1
InChIKeyUVETWUPFHYBGEU-CQSZACIVSA-N
MW292.43 g/mol
LogP1.57
Rot. Bonds5

About 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide

2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide (PubChem CID 51599887) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide
PubChem CID51599887
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide
SMILESCc1nn(C)c(C)c1CCNC(=O)C[C@H]1CCCCN1C
InChIInChI=1S/C16H28N4O/c1-12-15(13(2)20(4)18-12)8-9-17-16(21)11-14-7-5-6-10-19(14)3/h14H,5-11H2,1-4H3,(H,17,21)/t14-/m1/s1
InChIKeyUVETWUPFHYBGEU-CQSZACIVSA-N
XLogP1.57
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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4-(cyclopropanecarbonyl)-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]-1,4-diazepane-1-carboxamide
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CID 86930102
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2-methyl-3-(methylamino)-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]propanamide
CID 119731668
N-cyclopentyl-2-[(3S)-4-[3-(1,3,5-trimethylpyrazol-4-yl)propanoyl]morpholin-3-yl]acetamide
CID 95872613
N-[(4-methylphenyl)methyl]-2-(1-methylpiperidin-2-yl)acetamide
CID 110850894
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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide?
The IUPAC name of 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide (CID 51599887) is 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide?
The canonical SMILES for 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide is Cc1nn(C)c(C)c1CCNC(=O)C[C@H]1CCCCN1C.
What is the InChIKey of 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide?
The InChIKey is UVETWUPFHYBGEU-CQSZACIVSA-N. The full InChI is InChI=1S/C16H28N4O/c1-12-15(13(2)20(4)18-12)8-9-17-16(21)11-14-7-5-6-10-19(14)3/h14H,5-11H2,1-4H3,(H,17,21)/t14-/m1/s1.
What are the key properties of 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide?
2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide has a molecular weight of 292.43 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-1-methylpiperidin-2-yl]-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]acetamide is sourced from PubChem (CID 51599887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).