N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide

C16H28N2O3 — CID 111426381

IUPACN-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide
SMILESCCC(=O)N1CCCCC1C(=O)NCC(O)C1CCCC1
InChIInChI=1S/C16H28N2O3/c1-2-15(20)18-10-6-5-9-13(18)16(21)17-11-14(19)12-7-3-4-8-12/h12-14,19H,2-11H2,1H3,(H,17,21)
InChIKeyNELMZIBKGJKRHQ-UHFFFAOYSA-N
MW296.41 g/mol
LogP1.44
Rot. Bonds5

About N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide

N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide (PubChem CID 111426381) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide
PubChem CID111426381
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC NameN-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide
SMILESCCC(=O)N1CCCCC1C(=O)NCC(O)C1CCCC1
InChIInChI=1S/C16H28N2O3/c1-2-15(20)18-10-6-5-9-13(18)16(21)17-11-14(19)12-7-3-4-8-12/h12-14,19H,2-11H2,1H3,(H,17,21)
InChIKeyNELMZIBKGJKRHQ-UHFFFAOYSA-N
XLogP1.44
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxy-4-methylpentyl)-1-propanoylpiperidine-2-carboxamide
CID 111461149
N-[2-(furan-2-yl)-2-hydroxyethyl]-1-propanoylpiperidine-2-carboxamide
CID 110906621
N-(4-hydroxy-2,2-dimethylpentyl)-1-propanoylpiperidine-2-carboxamide
CID 111480417
1-propanoylpiperidine-2-carboxamide
CID 60717244
2-[(3-methylphenyl)methyl]-3-[(1-propanoylpiperidine-2-carbonyl)amino]propanoic acid
CID 119242959
4-[2-[(1-propanoylpiperidine-2-carbonyl)amino]ethyl]benzoic acid
CID 119168696
(2S)-N-(3-phenylprop-2-ynyl)-1-propanoylpiperidine-2-carboxamide
CID 94819073
N-ethyl-1-(3-methylbutanoyl)pyrrolidine-2-carboxamide
CID 170386383
1-[2-(1-hydroxyethyl)piperidin-1-yl]propan-1-one
CID 130621072
N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-1-propanoylpiperidine-2-carboxamide
CID 55835703
(2S)-1-N-cyclohexyl-2-N-(2-methylpropyl)pyrrolidine-1,2-dicarboxamide
CID 1468475
(2R)-1-propanoylpyrrolidine-2-carboxamide
CID 92979578

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide?
The IUPAC name of N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide (CID 111426381) is N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide?
The canonical SMILES for N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide is CCC(=O)N1CCCCC1C(=O)NCC(O)C1CCCC1.
What is the InChIKey of N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide?
The InChIKey is NELMZIBKGJKRHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-2-15(20)18-10-6-5-9-13(18)16(21)17-11-14(19)12-7-3-4-8-12/h12-14,19H,2-11H2,1H3,(H,17,21).
What are the key properties of N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide?
N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide has a molecular weight of 296.41 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyl-2-hydroxyethyl)-1-propanoylpiperidine-2-carboxamide is sourced from PubChem (CID 111426381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).