N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide

C14H24N2O — CID 114154046

IUPACN-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NCCC2=CCCC2)CCNC1
InChIInChI=1S/C14H24N2O/c1-2-14(8-10-15-11-14)13(17)16-9-7-12-5-3-4-6-12/h5,15H,2-4,6-11H2,1H3,(H,16,17)
InChIKeyWIHHLOFAPYHAGJ-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.99
Rot. Bonds5

About N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide

N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide (PubChem CID 114154046) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide
PubChem CID114154046
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NCCC2=CCCC2)CCNC1
InChIInChI=1S/C14H24N2O/c1-2-14(8-10-15-11-14)13(17)16-9-7-12-5-3-4-6-12/h5,15H,2-4,6-11H2,1H3,(H,16,17)
InChIKeyWIHHLOFAPYHAGJ-UHFFFAOYSA-N
XLogP1.99
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide
CID 114154033
N-[2-(cyclopenten-1-yl)ethyl]-2-methylpyrrolidine-2-carboxamide
CID 106175171
3-ethyl-N-[2-(4-fluorophenyl)ethyl]piperidine-3-carboxamide
CID 63132469
N-[2-(cyclohexen-1-yl)ethyl]-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
CID 107423829
1-(aminomethyl)-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide
CID 115437246
3-[(3-ethylpiperidine-3-carbonyl)amino]propanoic acid
CID 63131870
3-ethyl-N-octylpyrrolidine-3-carboxamide
CID 115567862
3-ethyl-N-[2-(furan-2-yl)ethyl]piperidine-3-carboxamide
CID 63130359
3-ethyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-3-carboxamide
CID 114183577
3-ethyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-3-carboxamide
CID 106397914
methyl 3-[(3-ethylpyrrolidine-3-carbonyl)amino]propanoate
CID 63141454
N-(4-amino-4-oxobutyl)-3-ethylpyrrolidine-3-carboxamide
CID 63139989

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide?
The IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide (CID 114154046) is N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide?
The canonical SMILES for N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide is CCC1(C(=O)NCCC2=CCCC2)CCNC1.
What is the InChIKey of N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide?
The InChIKey is WIHHLOFAPYHAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-2-14(8-10-15-11-14)13(17)16-9-7-12-5-3-4-6-12/h5,15H,2-4,6-11H2,1H3,(H,16,17).
What are the key properties of N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide?
N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide has a molecular weight of 236.36 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopenten-1-yl)ethyl]-3-ethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 114154046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).