N-(1-heptylpiperidin-3-yl)acetamide

C14H28N2O — CID 21122308

IUPACN-(1-heptylpiperidin-3-yl)acetamide
SMILESCCCCCCCN1CCCC(NC(C)=O)C1
InChIInChI=1S/C14H28N2O/c1-3-4-5-6-7-10-16-11-8-9-14(12-16)15-13(2)17/h14H,3-12H2,1-2H3,(H,15,17)
InChIKeyOHPBVBQWJFDCBL-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.56
Rot. Bonds7

About N-(1-heptylpiperidin-3-yl)acetamide

N-(1-heptylpiperidin-3-yl)acetamide (PubChem CID 21122308) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(1-heptylpiperidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-heptylpiperidin-3-yl)acetamide
PubChem CID21122308
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(1-heptylpiperidin-3-yl)acetamide
SMILESCCCCCCCN1CCCC(NC(C)=O)C1
InChIInChI=1S/C14H28N2O/c1-3-4-5-6-7-10-16-11-8-9-14(12-16)15-13(2)17/h14H,3-12H2,1-2H3,(H,15,17)
InChIKeyOHPBVBQWJFDCBL-UHFFFAOYSA-N
XLogP2.56
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(3-acetamidopiperidin-1-yl)-N-pentylacetamide
CID 87014513
N-[1-[3-(methanesulfonamido)propyl]piperidin-3-yl]acetamide
CID 86842614
N-[1-(3-phenylpropyl)piperidin-3-yl]acetamide
CID 171328429
[(3S)-1-propylpiperidin-3-yl]carbamic acid
CID 118936390
N-(1-butylpiperidin-4-yl)acetamide
CID 21136025
1-butyl-N-methylpiperidin-3-amine
CID 62534430
N-[(3S)-1-[2-[(3S)-3-(propanoylamino)piperidin-1-yl]ethyl]piperidin-3-yl]propanamide
CID 96549596
N-[1-(2,2,2-trifluoroethyl)piperidin-3-yl]acetamide
CID 126774083
1-heptyl-3-methylpiperidine;methanesulfonic acid
CID 175583555
methyl (3S)-1-decylpiperidine-3-carboxylate
CID 115537543
(3S)-1-dodecylpiperidine-3-carboxamide
CID 98141559
N-[1-(2-aminoethyl)pyrrolidin-3-yl]acetamide
CID 23450282

Frequently Asked Questions

What is the IUPAC name of N-(1-heptylpiperidin-3-yl)acetamide?
The IUPAC name of N-(1-heptylpiperidin-3-yl)acetamide (CID 21122308) is N-(1-heptylpiperidin-3-yl)acetamide.
What is the SMILES notation for N-(1-heptylpiperidin-3-yl)acetamide?
The canonical SMILES for N-(1-heptylpiperidin-3-yl)acetamide is CCCCCCCN1CCCC(NC(C)=O)C1.
What is the InChIKey of N-(1-heptylpiperidin-3-yl)acetamide?
The InChIKey is OHPBVBQWJFDCBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-4-5-6-7-10-16-11-8-9-14(12-16)15-13(2)17/h14H,3-12H2,1-2H3,(H,15,17).
What are the key properties of N-(1-heptylpiperidin-3-yl)acetamide?
N-(1-heptylpiperidin-3-yl)acetamide has a molecular weight of 240.39 g/mol, XLogP of 2.56, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-heptylpiperidin-3-yl)acetamide is sourced from PubChem (CID 21122308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).