N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide

C13H26N2O — CID 114424587

IUPACN-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide
SMILESCCC(CC)CNC(=O)C1CC(C)CCN1
InChIInChI=1S/C13H26N2O/c1-4-11(5-2)9-15-13(16)12-8-10(3)6-7-14-12/h10-12,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyIZCJUMMAKLJVLB-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.93
Rot. Bonds5

About N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide

N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide (PubChem CID 114424587) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide
PubChem CID114424587
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide
SMILESCCC(CC)CNC(=O)C1CC(C)CCN1
InChIInChI=1S/C13H26N2O/c1-4-11(5-2)9-15-13(16)12-8-10(3)6-7-14-12/h10-12,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyIZCJUMMAKLJVLB-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-dichloroethyl)-4-methylpiperidine-2-carboxamide
CID 130551928
N-(2-ethoxypropyl)-4-methylpiperidine-2-carboxamide
CID 114424533
N-(2-hydroxypentyl)-4-methylpiperidine-2-carboxamide
CID 114424561
N-(2-methoxypropyl)-4-methylpiperidine-2-carboxamide
CID 102695128
4-methyl-N-(2-methylsulfanylpropyl)piperidine-2-carboxamide
CID 114424521
4-ethyl-6-[(4-methylpiperidine-2-carbonyl)amino]hexanoic acid
CID 114424091
4-methyl-N-(2-methylsulfinylpropyl)piperidine-2-carboxamide
CID 114424544
4,4-dimethyl-2-[[(4-methylpiperidine-2-carbonyl)amino]methyl]pentanoic acid
CID 107475534
N-(2,2-dimethylbutyl)-4-methylpiperidine-2-carboxamide
CID 103461667
N-[2-(carbamoylamino)ethyl]-4-methylpiperidine-2-carboxamide
CID 114424437
4-methyl-N-[(4-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 114424006
4-methyl-N-(3-methylbut-2-enyl)piperidine-2-carboxamide
CID 106186997

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide?
The IUPAC name of N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide (CID 114424587) is N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide is CCC(CC)CNC(=O)C1CC(C)CCN1.
What is the InChIKey of N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide?
The InChIKey is IZCJUMMAKLJVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-11(5-2)9-15-13(16)12-8-10(3)6-7-14-12/h10-12,14H,4-9H2,1-3H3,(H,15,16).
What are the key properties of N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide?
N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide has a molecular weight of 226.36 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide is sourced from PubChem (CID 114424587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).