2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide

C16H30N2O2 — CID 110819505

IUPAC2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide
SMILESCCCCC(=O)N1CCC(NC(=O)C(CC)CC)CC1
InChIInChI=1S/C16H30N2O2/c1-4-7-8-15(19)18-11-9-14(10-12-18)17-16(20)13(5-2)6-3/h13-14H,4-12H2,1-3H3,(H,17,20)
InChIKeyPRELRNSGSCVDBS-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.72
Rot. Bonds7

About 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide

2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide (PubChem CID 110819505) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide.

Molecular Properties

Compound Name2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide
PubChem CID110819505
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide
SMILESCCCCC(=O)N1CCC(NC(=O)C(CC)CC)CC1
InChIInChI=1S/C16H30N2O2/c1-4-7-8-15(19)18-11-9-14(10-12-18)17-16(20)13(5-2)6-3/h13-14H,4-12H2,1-3H3,(H,17,20)
InChIKeyPRELRNSGSCVDBS-UHFFFAOYSA-N
XLogP2.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-diethyl-3-(1-pentanoylpiperidin-4-yl)urea
CID 108566126
1-[4-(methylamino)piperidin-1-yl]hexan-1-one
CID 60818219
N-[1-[4-(2-chlorophenoxy)butanoyl]piperidin-4-yl]-2-ethylbutanamide
CID 108555612
N-cyclopropyl-2-ethylbutanamide
CID 5151098
N-(1-pentanoylpiperidin-4-yl)propane-1-sulfonamide
CID 110819565
1-[4,7,10,13,16-penta(pentanoyl)-1,4,7,10,13,16-hexazacyclooctadec-1-yl]pentan-1-one
CID 603333
N-cyclopropyl-2-(4-pentanoylpiperazin-1-yl)acetamide
CID 110709694
N-[1-(6-aminohexanoyl)piperidin-4-yl]-2-methylpropanamide
CID 60947434
N-[1-[4-(methylamino)butanoyl]piperidin-4-yl]butanamide
CID 54871679
N-(1-butanoylpiperidin-4-yl)cyclopropanecarboxamide
CID 60758370
1-[4-(2-methylpropyl)piperidin-1-yl]pentan-1-one
CID 171554697
1-(4-methoxypiperidin-1-yl)pentan-1-one
CID 110725259

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide?
The IUPAC name of 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide (CID 110819505) is 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide.
What is the SMILES notation for 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide?
The canonical SMILES for 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide is CCCCC(=O)N1CCC(NC(=O)C(CC)CC)CC1.
What is the InChIKey of 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide?
The InChIKey is PRELRNSGSCVDBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-4-7-8-15(19)18-11-9-14(10-12-18)17-16(20)13(5-2)6-3/h13-14H,4-12H2,1-3H3,(H,17,20).
What are the key properties of 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide?
2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide has a molecular weight of 282.43 g/mol, XLogP of 2.72, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(1-pentanoylpiperidin-4-yl)butanamide is sourced from PubChem (CID 110819505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).