N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride

C14H23ClN4O2 — CID 120837646

IUPACN-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCc1nc(C2CCCC2)no1)C1CCCN1
InChIInChI=1S/C14H22N4O2.ClH/c19-14(11-6-3-8-15-11)16-9-7-12-17-13(18-20-12)10-4-1-2-5-10;/h10-11,15H,1-9H2,(H,16,19);1H
InChIKeyGLUXYCYMVGCIIB-UHFFFAOYSA-N
MW314.82 g/mol
LogP1.56
Rot. Bonds5

About N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride

N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 120837646) has the molecular formula C14H23ClN4O2 and a molecular weight of 314.82 g/mol. Its IUPAC name is N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
PubChem CID120837646
Molecular FormulaC14H23ClN4O2
Molecular Weight314.82 g/mol
Exact Mass314.15
IUPAC NameN-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCc1nc(C2CCCC2)no1)C1CCCN1
InChIInChI=1S/C14H22N4O2.ClH/c19-14(11-6-3-8-15-11)16-9-7-12-17-13(18-20-12)10-4-1-2-5-10;/h10-11,15H,1-9H2,(H,16,19);1H
InChIKeyGLUXYCYMVGCIIB-UHFFFAOYSA-N
XLogP1.56
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.82
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-cyclohexyl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 120837799
N-[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119326195
N-[2-[3-(4-fluoro-3-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrrolidine-2-carboxamide
CID 120838741
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119320896
N-[2-[3-(3-chloro-4,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 120838788
3-(3-cycloheptyl-1,2,4-oxadiazol-5-yl)propanoic acid
CID 65390508
3-cyclopentyl-5-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazole
CID 61371735
(2S)-N-[2-(4-fluorophenyl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119263955
N-[2-(4-methoxyphenyl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119262908
N-[2-[3-[4-(pyridin-3-ylmethoxy)phenyl]-1,2,4-oxadiazol-5-yl]ethyl]pyrrolidine-2-carboxamide
CID 120839869
4-(3-cycloheptyl-1,2,4-oxadiazol-5-yl)butanoic acid
CID 65390511
N-[2-(3,5-dimethylphenyl)ethyl]pyrrolidine-2-carboxamide
CID 83632123

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride (CID 120837646) is N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride is Cl.O=C(NCCc1nc(C2CCCC2)no1)C1CCCN1.
What is the InChIKey of N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is GLUXYCYMVGCIIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2.ClH/c19-14(11-6-3-8-15-11)16-9-7-12-17-13(18-20-12)10-4-1-2-5-10;/h10-11,15H,1-9H2,(H,16,19);1H.
What are the key properties of N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride?
N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 314.82 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 120837646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).