N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide

C15H30N2O — CID 107147985

IUPACN-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide
SMILESCC(C)CCCCNC(=O)CC1NCCCC1C
InChIInChI=1S/C15H30N2O/c1-12(2)7-4-5-9-17-15(18)11-14-13(3)8-6-10-16-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)
InChIKeyNRCLCEKBMBRJSH-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.71
Rot. Bonds7

About N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide

N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide (PubChem CID 107147985) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide
PubChem CID107147985
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide
SMILESCC(C)CCCCNC(=O)CC1NCCCC1C
InChIInChI=1S/C15H30N2O/c1-12(2)7-4-5-9-17-15(18)11-14-13(3)8-6-10-16-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)
InChIKeyNRCLCEKBMBRJSH-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.71
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

N-(3-butoxypropyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107148072
N-(7-methyloctyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119263597
N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide
CID 107147671
N-(2-methylcyclohexyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147462
(2R)-N-(7-methyloctyl)piperidine-2-carboxamide
CID 103807890
N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide
CID 114174284
2-(3-methylpiperidin-2-yl)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 107147559
2-methyl-N-[2-[(2-pyrrolidin-2-ylacetyl)amino]ethyl]propanamide
CID 61365863
N-(3-methylcyclopentyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107148093
N-octyl-2-pyrrolidin-2-ylacetamide
CID 115567860
N-[3-(2-methylpropoxy)propyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119693624
N,N-dimethyl-2-(3-methylpiperidin-2-yl)acetamide
CID 107147512

Frequently Asked Questions

What is the IUPAC name of N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide (CID 107147985) is N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide is CC(C)CCCCNC(=O)CC1NCCCC1C.
What is the InChIKey of N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide?
The InChIKey is NRCLCEKBMBRJSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12(2)7-4-5-9-17-15(18)11-14-13(3)8-6-10-16-14/h12-14,16H,4-11H2,1-3H3,(H,17,18).
What are the key properties of N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide?
N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide has a molecular weight of 254.42 g/mol, XLogP of 2.71, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 107147985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).