N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide

C12H20N2O — CID 138976973

IUPACN-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide
SMILESC=CC1(NC(=O)N2CCCC2)CCCC1
InChIInChI=1S/C12H20N2O/c1-2-12(7-3-4-8-12)13-11(15)14-9-5-6-10-14/h2H,1,3-10H2,(H,13,15)
InChIKeyZAGNDTQHRHWFLH-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.29
Rot. Bonds2

About N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide

N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide (PubChem CID 138976973) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide
PubChem CID138976973
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide
SMILESC=CC1(NC(=O)N2CCCC2)CCCC1
InChIInChI=1S/C12H20N2O/c1-2-12(7-3-4-8-12)13-11(15)14-9-5-6-10-14/h2H,1,3-10H2,(H,13,15)
InChIKeyZAGNDTQHRHWFLH-UHFFFAOYSA-N
XLogP2.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide (CID 138976973) is N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide is C=CC1(NC(=O)N2CCCC2)CCCC1.
What is the InChIKey of N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide?
The InChIKey is ZAGNDTQHRHWFLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-2-12(7-3-4-8-12)13-11(15)14-9-5-6-10-14/h2H,1,3-10H2,(H,13,15).
What are the key properties of N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide?
N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide has a molecular weight of 208.30 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethenylcyclopentyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 138976973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).