N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide

C14H28N2O — CID 115619164

IUPACN-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide
SMILESCCC(CC)C(C)NC(=O)N1CCC(C)CC1
InChIInChI=1S/C14H28N2O/c1-5-13(6-2)12(4)15-14(17)16-9-7-11(3)8-10-16/h11-13H,5-10H2,1-4H3,(H,15,17)
InChIKeyLQJOVGLLGJWRIH-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.25
Rot. Bonds4

About N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide

N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide (PubChem CID 115619164) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide
PubChem CID115619164
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide
SMILESCCC(CC)C(C)NC(=O)N1CCC(C)CC1
InChIInChI=1S/C14H28N2O/c1-5-13(6-2)12(4)15-14(17)16-9-7-11(3)8-10-16/h11-13H,5-10H2,1-4H3,(H,15,17)
InChIKeyLQJOVGLLGJWRIH-UHFFFAOYSA-N
XLogP3.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2S)-1-hydroxypropan-2-yl]-4-methylpiperidine-1-carboxamide
CID 79159288
N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide
CID 96683106
(2S)-2-[(4-methylpiperidine-1-carbonyl)amino]propanoic acid
CID 942904
4-methyl-N-(2-methylbutyl)piperidine-1-carboxamide
CID 116655598
N-(dicyclopropylmethyl)-4-methylpiperidine-1-carboxamide
CID 113224116
N-(1-cyanoethyl)-4-methylpiperidine-1-carboxamide
CID 79160605
(2R)-3-hydroxy-2-[(4-methylpiperidine-1-carbonyl)amino]propanoic acid
CID 80750387
3-hydroxy-2-[(4-methylpiperidine-1-carbonyl)amino]propanoic acid
CID 61188214
4-methyl-N-(1-piperidin-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115583839
methyl 3-methyl-2-[(4-methylpiperidine-1-carbonyl)amino]butanoate
CID 5027485
4-methyl-N-propylpiperidine-1-carboxamide
CID 19169940
4-methyl-N-(3-methylbutyl)piperidine-1-carboxamide
CID 51712124

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide (CID 115619164) is N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide is CCC(CC)C(C)NC(=O)N1CCC(C)CC1.
What is the InChIKey of N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide?
The InChIKey is LQJOVGLLGJWRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-13(6-2)12(4)15-14(17)16-9-7-11(3)8-10-16/h11-13H,5-10H2,1-4H3,(H,15,17).
What are the key properties of N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide?
N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 115619164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).