N-[(6-methylpiperidin-2-yl)methyl]octanamide

C15H30N2O — CID 62322643

IUPACN-[(6-methylpiperidin-2-yl)methyl]octanamide
SMILESCCCCCCCC(=O)NCC1CCCC(C)N1
InChIInChI=1S/C15H30N2O/c1-3-4-5-6-7-11-15(18)16-12-14-10-8-9-13(2)17-14/h13-14,17H,3-12H2,1-2H3,(H,16,18)
InChIKeyFQPXZSZCMJASFO-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.99
Rot. Bonds8

About N-[(6-methylpiperidin-2-yl)methyl]octanamide

N-[(6-methylpiperidin-2-yl)methyl]octanamide (PubChem CID 62322643) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[(6-methylpiperidin-2-yl)methyl]octanamide.

Molecular Properties

Compound NameN-[(6-methylpiperidin-2-yl)methyl]octanamide
PubChem CID62322643
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[(6-methylpiperidin-2-yl)methyl]octanamide
SMILESCCCCCCCC(=O)NCC1CCCC(C)N1
InChIInChI=1S/C15H30N2O/c1-3-4-5-6-7-11-15(18)16-12-14-10-8-9-13(2)17-14/h13-14,17H,3-12H2,1-2H3,(H,16,18)
InChIKeyFQPXZSZCMJASFO-UHFFFAOYSA-N
XLogP2.99
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 ≤ 52.99
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-cyclopentyl-N-[(6-methylpiperidin-2-yl)methyl]acetamide
CID 62322637
N-[[2-(chloromethyl)cyclopentyl]methyl]octanamide
CID 113273844
N-[[2-(chloromethyl)cyclopentyl]methyl]decanamide
CID 114306695
(2S,6R)-2-methyl-6-pentadecylpiperidine;hydrochloride
CID 24774422
N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride
CID 175666343
N-(2-pyrrolidin-2-ylethyl)octanamide
CID 114793852
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]dodecanamide
CID 104971837
N-(2-piperidin-2-ylethyl)octanamide
CID 43125232
N-(piperidin-4-ylmethyl)heptanamide
CID 115736684
(2R,6R)-2-methyl-6-[(Z)-pentadec-6-enyl]piperidine
CID 131877830
N-[(3-chlorocyclohexyl)methyl]heptanamide
CID 106132379
N-(pyrrolidin-3-ylmethyl)dodecanamide
CID 80564166

Frequently Asked Questions

What is the IUPAC name of N-[(6-methylpiperidin-2-yl)methyl]octanamide?
The IUPAC name of N-[(6-methylpiperidin-2-yl)methyl]octanamide (CID 62322643) is N-[(6-methylpiperidin-2-yl)methyl]octanamide.
What is the SMILES notation for N-[(6-methylpiperidin-2-yl)methyl]octanamide?
The canonical SMILES for N-[(6-methylpiperidin-2-yl)methyl]octanamide is CCCCCCCC(=O)NCC1CCCC(C)N1.
What is the InChIKey of N-[(6-methylpiperidin-2-yl)methyl]octanamide?
The InChIKey is FQPXZSZCMJASFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-4-5-6-7-11-15(18)16-12-14-10-8-9-13(2)17-14/h13-14,17H,3-12H2,1-2H3,(H,16,18).
What are the key properties of N-[(6-methylpiperidin-2-yl)methyl]octanamide?
N-[(6-methylpiperidin-2-yl)methyl]octanamide has a molecular weight of 254.42 g/mol, XLogP of 2.99, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methylpiperidin-2-yl)methyl]octanamide is sourced from PubChem (CID 62322643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).