2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide

C13H24N2O2 — CID 95296140

IUPAC2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide
SMILESCC(C)CCC(=O)N1CCCC[C@H]1CC(N)=O
InChIInChI=1S/C13H24N2O2/c1-10(2)6-7-13(17)15-8-4-3-5-11(15)9-12(14)16/h10-11H,3-9H2,1-2H3,(H2,14,16)/t11-/m0/s1
InChIKeyOINZRNJFWWHRFC-NSHDSACASA-N
MW240.35 g/mol
LogP1.68
Rot. Bonds5

About 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide

2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide (PubChem CID 95296140) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide.

Molecular Properties

Compound Name2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide
PubChem CID95296140
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide
SMILESCC(C)CCC(=O)N1CCCC[C@H]1CC(N)=O
InChIInChI=1S/C13H24N2O2/c1-10(2)6-7-13(17)15-8-4-3-5-11(15)9-12(14)16/h10-11H,3-9H2,1-2H3,(H2,14,16)/t11-/m0/s1
InChIKeyOINZRNJFWWHRFC-NSHDSACASA-N
XLogP1.68
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethylpiperidin-1-yl)-4-methylpentan-1-one
CID 150449781
1-[2-(2-hydroxypropyl)azepan-1-yl]-4-methylpentan-1-one
CID 79560929
4-amino-1-[2-(3-methylbutyl)piperidin-1-yl]pentan-1-one
CID 120564107
2-[1-[(2S)-2-aminopropanoyl]piperidin-2-yl]acetamide;hydrochloride
CID 119307888
2-[1-[2-(methylamino)acetyl]piperidin-2-yl]acetamide;hydrochloride
CID 119756579
N'-hydroxy-1-(4-methylpentanoyl)pyrrolidine-2-carboximidamide
CID 77036265
1-[2-(aminomethyl)azepan-1-yl]-4-methoxypentan-1-one
CID 116640028
3-amino-1-[2-(2-methylpropyl)piperidin-1-yl]propan-1-one;hydrochloride
CID 119334196
methyl 2-[1-(5-aminohexanoyl)piperidin-2-yl]acetate
CID 82852684
2-(1-acetylpyrrolidin-2-yl)acetamide
CID 127011222
5-amino-1-[2-(2-hydroxyethyl)piperidin-1-yl]-4-methylpentan-1-one
CID 82682909
6-amino-1-(2-ethylazepan-1-yl)-4-methylhexan-1-one
CID 113441676

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide?
The IUPAC name of 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide (CID 95296140) is 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide.
What is the SMILES notation for 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide?
The canonical SMILES for 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide is CC(C)CCC(=O)N1CCCC[C@H]1CC(N)=O.
What is the InChIKey of 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide?
The InChIKey is OINZRNJFWWHRFC-NSHDSACASA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10(2)6-7-13(17)15-8-4-3-5-11(15)9-12(14)16/h10-11H,3-9H2,1-2H3,(H2,14,16)/t11-/m0/s1.
What are the key properties of 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide?
2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide has a molecular weight of 240.35 g/mol, XLogP of 1.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-1-(4-methylpentanoyl)piperidin-2-yl]acetamide is sourced from PubChem (CID 95296140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).