2-ethyl-N-(1-piperidin-4-ylethyl)butanamide

C13H26N2O — CID 43523212

IUPAC2-ethyl-N-(1-piperidin-4-ylethyl)butanamide
SMILESCCC(CC)C(=O)NC(C)C1CCNCC1
InChIInChI=1S/C13H26N2O/c1-4-11(5-2)13(16)15-10(3)12-6-8-14-9-7-12/h10-12,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyCUFNTOGMSRCIEF-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.93
Rot. Bonds5

About 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide

2-ethyl-N-(1-piperidin-4-ylethyl)butanamide (PubChem CID 43523212) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide.

Molecular Properties

Compound Name2-ethyl-N-(1-piperidin-4-ylethyl)butanamide
PubChem CID43523212
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-ethyl-N-(1-piperidin-4-ylethyl)butanamide
SMILESCCC(CC)C(=O)NC(C)C1CCNCC1
InChIInChI=1S/C13H26N2O/c1-4-11(5-2)13(16)15-10(3)12-6-8-14-9-7-12/h10-12,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyCUFNTOGMSRCIEF-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-1-methyl-3-(1-piperidin-4-ylethyl)urea
CID 79159834
N-(1-piperidin-4-ylethyl)acetamide
CID 43523156
2-(aminomethyl)-N-(1-cyclohexylethyl)butanamide
CID 62405592
4-methyl-N-(1-piperidin-4-ylethyl)pentanamide
CID 43523174
2-bromo-N-(1-cyclopropylethyl)butanamide
CID 62856130
2-cyclopropyl-N-(1-pyrrolidin-3-ylethyl)propanamide
CID 103977089
N-(1-piperidin-4-ylethyl)cyclooctanecarboxamide
CID 65018639
3,4,4-trimethyl-N-(1-piperidin-4-ylethyl)pentanamide
CID 55260130
N-butan-2-yl-3-piperidin-4-ylbutanamide
CID 119669606
N-[(1S)-1-cyclopropylethyl]-2-methylpentanamide
CID 161003325
N-[(1R)-1-cyclohexylethyl]piperidine-4-carboxamide
CID 81385810
N-[1-(butan-2-ylamino)-1-oxopropan-2-yl]-3-piperidin-4-ylbutanamide
CID 119756301

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide?
The IUPAC name of 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide (CID 43523212) is 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide.
What is the SMILES notation for 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide?
The canonical SMILES for 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide is CCC(CC)C(=O)NC(C)C1CCNCC1.
What is the InChIKey of 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide?
The InChIKey is CUFNTOGMSRCIEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-11(5-2)13(16)15-10(3)12-6-8-14-9-7-12/h10-12,14H,4-9H2,1-3H3,(H,15,16).
What are the key properties of 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide?
2-ethyl-N-(1-piperidin-4-ylethyl)butanamide has a molecular weight of 226.36 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(1-piperidin-4-ylethyl)butanamide is sourced from PubChem (CID 43523212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).