N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide

C14H26N2O2 — CID 110349052

IUPACN-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide
SMILESCCCC(=O)N[C@H](C(=O)N1CCCCC1)C(C)C
InChIInChI=1S/C14H26N2O2/c1-4-8-12(17)15-13(11(2)3)14(18)16-9-6-5-7-10-16/h11,13H,4-10H2,1-3H3,(H,15,17)/t13-/m0/s1
InChIKeyFJMAYFSYKVUZIF-ZDUSSCGKSA-N
MW254.37 g/mol
LogP1.94
Rot. Bonds5

About N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide

N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide (PubChem CID 110349052) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide.

Molecular Properties

Compound NameN-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide
PubChem CID110349052
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide
SMILESCCCC(=O)N[C@H](C(=O)N1CCCCC1)C(C)C
InChIInChI=1S/C14H26N2O2/c1-4-8-12(17)15-13(11(2)3)14(18)16-9-6-5-7-10-16/h11,13H,4-10H2,1-3H3,(H,15,17)/t13-/m0/s1
InChIKeyFJMAYFSYKVUZIF-ZDUSSCGKSA-N
XLogP1.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[(2S)-3-methyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]butanamide
CID 110348621
N-[(2S)-1-(azepan-1-yl)-3-methyl-1-oxobutan-2-yl]-2-phenylacetamide
CID 9036546
N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]-3-phenoxypropanamide
CID 110349075
ethyl 1-[3-methyl-2-(pentanoylamino)butanoyl]piperidine-3-carboxylate
CID 42697442
methyl N-[(2S)-3-methyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]carbamate
CID 58449518
2,2-dimethyl-N-[(2S)-3-methyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]propanamide
CID 110348620
(3-methyl-1-oxo-1-piperidin-1-ylpentan-2-yl)urea
CID 60634937
(2E)-2-hydroxyimino-N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]propanamide
CID 15138122
tert-butyl N-[1-(azocan-1-yl)-3-methyl-1-oxobutan-2-yl]carbamate
CID 142133698
2-(3,4-dimethoxyphenyl)-N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]acetamide
CID 110349084
(3S)-1-[3-methyl-2-(3-methylbutanoylamino)butanoyl]piperidine-3-carboxylic acid
CID 119174275
N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]butanamide
CID 110347349

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide?
The IUPAC name of N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide (CID 110349052) is N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide.
What is the SMILES notation for N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide?
The canonical SMILES for N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide is CCCC(=O)N[C@H](C(=O)N1CCCCC1)C(C)C.
What is the InChIKey of N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide?
The InChIKey is FJMAYFSYKVUZIF-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-4-8-12(17)15-13(11(2)3)14(18)16-9-6-5-7-10-16/h11,13H,4-10H2,1-3H3,(H,15,17)/t13-/m0/s1.
What are the key properties of N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide?
N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide has a molecular weight of 254.37 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]butanamide is sourced from PubChem (CID 110349052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).