2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide

C14H26N2O2 — CID 95747727

IUPAC2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide
SMILESCCC(CC)C(=O)N[C@H](C)C(=O)N1CCCCC1
InChIInChI=1S/C14H26N2O2/c1-4-12(5-2)13(17)15-11(3)14(18)16-9-7-6-8-10-16/h11-12H,4-10H2,1-3H3,(H,15,17)/t11-/m1/s1
InChIKeyVJVBCZSCUBBVME-LLVKDONJSA-N
MW254.37 g/mol
LogP1.94
Rot. Bonds5

About 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide

2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide (PubChem CID 95747727) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide
PubChem CID95747727
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide
SMILESCCC(CC)C(=O)N[C@H](C)C(=O)N1CCCCC1
InChIInChI=1S/C14H26N2O2/c1-4-12(5-2)13(17)15-11(3)14(18)16-9-7-6-8-10-16/h11-12H,4-10H2,1-3H3,(H,15,17)/t11-/m1/s1
InChIKeyVJVBCZSCUBBVME-LLVKDONJSA-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-methyl-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)butanamide
CID 110280633
(2S)-2-amino-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)butanamide;hydrochloride
CID 119292063
2-ethyl-N-[(2S)-3-methyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]butanamide
CID 110348621
ethyl 4-[(2S)-2-(2-ethylbutanoylamino)propanoyl]piperazine-1-carboxylate
CID 110348482
2-cyano-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)butanamide
CID 113408600
2-(pentan-3-ylamino)-1-piperidin-1-ylpropan-1-one
CID 43083625
2-(aminomethyl)-4,4-dimethyl-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)pentanamide
CID 107471478
2-amino-3-methyl-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)butanamide
CID 54863272
(2R)-2-amino-3-methyl-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)butanamide
CID 79013484
1-(2-methylpentan-3-yl)-3-(1-oxo-1-piperidin-1-ylpropan-2-yl)urea
CID 47481518
(2S)-2-amino-4-methyl-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)pentanamide
CID 61180719
(2S,3R)-3-methyl-N-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]-2-[(2,2,2-trifluoroacetyl)amino]pentanamide
CID 102590703

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide?
The IUPAC name of 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide (CID 95747727) is 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide.
What is the SMILES notation for 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide?
The canonical SMILES for 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide is CCC(CC)C(=O)N[C@H](C)C(=O)N1CCCCC1.
What is the InChIKey of 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide?
The InChIKey is VJVBCZSCUBBVME-LLVKDONJSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-4-12(5-2)13(17)15-11(3)14(18)16-9-7-6-8-10-16/h11-12H,4-10H2,1-3H3,(H,15,17)/t11-/m1/s1.
What are the key properties of 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide?
2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-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 2-ethyl-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]butanamide is sourced from PubChem (CID 95747727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).