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

C15H26N2O — CID 114154033

IUPACN-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide
SMILESCCCC1(C(=O)NCCC2=CCCC2)CCNC1
InChIInChI=1S/C15H26N2O/c1-2-8-15(9-11-16-12-15)14(18)17-10-7-13-5-3-4-6-13/h5,16H,2-4,6-12H2,1H3,(H,17,18)
InChIKeyGNNRFRXQMFVIIJ-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.38
Rot. Bonds6

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

N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide (PubChem CID 114154033) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide
PubChem CID114154033
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide
SMILESCCCC1(C(=O)NCCC2=CCCC2)CCNC1
InChIInChI=1S/C15H26N2O/c1-2-8-15(9-11-16-12-15)14(18)17-10-7-13-5-3-4-6-13/h5,16H,2-4,6-12H2,1H3,(H,17,18)
InChIKeyGNNRFRXQMFVIIJ-UHFFFAOYSA-N
XLogP2.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.38
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-ethylpyrrolidine-3-carboxamide
CID 114154046
N-[2-(cyclopenten-1-yl)ethyl]-2-methylpyrrolidine-2-carboxamide
CID 106175171
4-[(3-propylpiperidine-3-carbonyl)amino]butanoic acid
CID 63132002
N-(2-cyclopentyloxyethyl)-3-propylpyrrolidine-3-carboxamide
CID 55261464
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
N-(4-aminobutyl)-3-propylpiperidine-3-carboxamide
CID 63135295
N-[3-(diethylamino)propyl]-3-propylpyrrolidine-3-carboxamide
CID 63138470
N-[2-(dimethylcarbamoylamino)ethyl]-3-propylpiperidine-3-carboxamide
CID 83109256
3-propyl-N-(5,5,5-trifluoropentyl)pyrrolidine-3-carboxamide
CID 115519402
1-cyano-N-[2-(cyclopenten-1-yl)ethyl]cyclohexane-1-carboxamide
CID 113330028
(2S)-2-hydroxy-4-[(3-propylpiperidine-3-carbonyl)amino]butanoic acid
CID 107836459

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide?
The IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide (CID 114154033) is N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide?
The canonical SMILES for N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide is CCCC1(C(=O)NCCC2=CCCC2)CCNC1.
What is the InChIKey of N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide?
The InChIKey is GNNRFRXQMFVIIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-2-8-15(9-11-16-12-15)14(18)17-10-7-13-5-3-4-6-13/h5,16H,2-4,6-12H2,1H3,(H,17,18).
What are the key properties of N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide?
N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide has a molecular weight of 250.39 g/mol, XLogP of 2.38, 6 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-propylpyrrolidine-3-carboxamide is sourced from PubChem (CID 114154033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).