N-octan-2-yl-2-piperidin-4-ylacetamide

C15H30N2O — CID 54910396

IUPACN-octan-2-yl-2-piperidin-4-ylacetamide
SMILESCCCCCCC(C)NC(=O)CC1CCNCC1
InChIInChI=1S/C15H30N2O/c1-3-4-5-6-7-13(2)17-15(18)12-14-8-10-16-11-9-14/h13-14,16H,3-12H2,1-2H3,(H,17,18)
InChIKeyJHYKBTOLQXNZHS-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.85
Rot. Bonds8

About N-octan-2-yl-2-piperidin-4-ylacetamide

N-octan-2-yl-2-piperidin-4-ylacetamide (PubChem CID 54910396) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-octan-2-yl-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-octan-2-yl-2-piperidin-4-ylacetamide
PubChem CID54910396
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-octan-2-yl-2-piperidin-4-ylacetamide
SMILESCCCCCCC(C)NC(=O)CC1CCNCC1
InChIInChI=1S/C15H30N2O/c1-3-4-5-6-7-13(2)17-15(18)12-14-8-10-16-11-9-14/h13-14,16H,3-12H2,1-2H3,(H,17,18)
InChIKeyJHYKBTOLQXNZHS-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(4-aminocyclohexyl)-N-heptan-2-ylacetamide
CID 62781706
N-(4-hydroxybutan-2-yl)-2-piperidin-4-ylacetamide
CID 83177313
N-(4-methylpentan-2-yl)-2-piperidin-4-ylacetamide
CID 43372444
2-[(2-piperidin-4-ylacetyl)amino]-N-propylpropanamide
CID 54980022
N-dodecan-2-ylpropanamide
CID 174988669
N-[(2R)-1-hydroxypropan-2-yl]-2-pyrrolidin-3-ylacetamide
CID 107218668
1-piperidin-4-ylundecan-2-one
CID 116559812
N-octadecan-2-ylhexadecanamide
CID 87600664
N-heptan-2-yldodecanamide
CID 3484810
(3S)-N-heptan-2-ylpiperidine-3-carboxamide
CID 81123711
2-chloro-N-[(2R)-octan-2-yl]acetamide
CID 7131842
2-(azetidin-3-ylmethylsulfanyl)-N-heptan-2-ylacetamide
CID 66290727

Frequently Asked Questions

What is the IUPAC name of N-octan-2-yl-2-piperidin-4-ylacetamide?
The IUPAC name of N-octan-2-yl-2-piperidin-4-ylacetamide (CID 54910396) is N-octan-2-yl-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-octan-2-yl-2-piperidin-4-ylacetamide?
The canonical SMILES for N-octan-2-yl-2-piperidin-4-ylacetamide is CCCCCCC(C)NC(=O)CC1CCNCC1.
What is the InChIKey of N-octan-2-yl-2-piperidin-4-ylacetamide?
The InChIKey is JHYKBTOLQXNZHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-4-5-6-7-13(2)17-15(18)12-14-8-10-16-11-9-14/h13-14,16H,3-12H2,1-2H3,(H,17,18).
What are the key properties of N-octan-2-yl-2-piperidin-4-ylacetamide?
N-octan-2-yl-2-piperidin-4-ylacetamide has a molecular weight of 254.42 g/mol, XLogP of 2.85, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-octan-2-yl-2-piperidin-4-ylacetamide is sourced from PubChem (CID 54910396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).