2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide

C15H28N2O2 — CID 63845307

IUPAC2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)N1CCC(C(C)=O)CC1
InChIInChI=1S/C15H28N2O2/c1-5-6-11(2)16-15(19)12(3)17-9-7-14(8-10-17)13(4)18/h11-12,14H,5-10H2,1-4H3,(H,16,19)
InChIKeyCZYSCLSMXHCCRF-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.98
Rot. Bonds6

About 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide

2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide (PubChem CID 63845307) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide
PubChem CID63845307
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)N1CCC(C(C)=O)CC1
InChIInChI=1S/C15H28N2O2/c1-5-6-11(2)16-15(19)12(3)17-9-7-14(8-10-17)13(4)18/h11-12,14H,5-10H2,1-4H3,(H,16,19)
InChIKeyCZYSCLSMXHCCRF-UHFFFAOYSA-N
XLogP1.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-acetylpiperidin-1-yl)-N-propan-2-ylpropanamide
CID 55258721
methyl (3S)-1-[1-oxo-1-(pentan-2-ylamino)propan-2-yl]piperidine-3-carboxylate
CID 79038248
4-methyl-1-[1-oxo-1-(pentan-2-ylamino)propan-2-yl]piperidine-4-carboxylic acid
CID 63124532
2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-pentan-2-ylpropanamide
CID 107160523
1-[1-oxo-1-(pentan-3-ylamino)propan-2-yl]pyrrolidine-3-carboxylic acid
CID 63032568
1-[1-oxo-1-(pentan-3-ylamino)propan-2-yl]pyrrolidine-3-carboxylic acid;hydrochloride
CID 119904594
2-[1-[1-oxo-1-(pentan-2-ylamino)propan-2-yl]piperidin-2-yl]acetic acid
CID 61010725
2-(1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl)-N-pentan-2-ylpropanamide
CID 102682327
1-[1-(ethylamino)-1-oxopropan-2-yl]piperidine-4-carboxylic acid
CID 43385831
2-(4-hydroxypiperidin-1-yl)-N-pentan-3-ylpropanamide
CID 60719341
N-butan-2-yl-2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)propanamide;hydrochloride
CID 119927531
ethane;1-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177135939

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide?
The IUPAC name of 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide (CID 63845307) is 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide is CCCC(C)NC(=O)C(C)N1CCC(C(C)=O)CC1.
What is the InChIKey of 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide?
The InChIKey is CZYSCLSMXHCCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-5-6-11(2)16-15(19)12(3)17-9-7-14(8-10-17)13(4)18/h11-12,14H,5-10H2,1-4H3,(H,16,19).
What are the key properties of 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide?
2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide has a molecular weight of 268.40 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperidin-1-yl)-N-pentan-2-ylpropanamide is sourced from PubChem (CID 63845307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).