2-cyclopentylidene-N-pyrrolidin-3-ylacetamide

C11H18N2O — CID 130678830

IUPAC2-cyclopentylidene-N-pyrrolidin-3-ylacetamide
SMILESO=C(C=C1CCCC1)NC1CCNC1
InChIInChI=1S/C11H18N2O/c14-11(7-9-3-1-2-4-9)13-10-5-6-12-8-10/h7,10,12H,1-6,8H2,(H,13,14)
InChIKeyOCNANEOJONLDFO-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.96
Rot. Bonds2

About 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide

2-cyclopentylidene-N-pyrrolidin-3-ylacetamide (PubChem CID 130678830) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound Name2-cyclopentylidene-N-pyrrolidin-3-ylacetamide
PubChem CID130678830
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-cyclopentylidene-N-pyrrolidin-3-ylacetamide
SMILESO=C(C=C1CCCC1)NC1CCNC1
InChIInChI=1S/C11H18N2O/c14-11(7-9-3-1-2-4-9)13-10-5-6-12-8-10/h7,10,12H,1-6,8H2,(H,13,14)
InChIKeyOCNANEOJONLDFO-UHFFFAOYSA-N
XLogP0.96
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-cyclobutylidene-N-[(3R)-piperidin-3-yl]acetamide
CID 130763180
N-[(3S)-pyrrolidin-3-yl]but-2-enamide
CID 79688217
ethane;N-pyrrolidin-3-ylprop-2-enamide
CID 145096848
1-pyrrolidin-3-yl-3-[(3R)-pyrrolidin-3-yl]urea
CID 66630468
1-cyclobutyl-3-pyrrolidin-3-ylurea
CID 116658204
3-methyl-N-piperidin-3-ylbut-2-enamide
CID 63321543
1-cyclopropyl-3-[(3R)-pyrrolidin-3-yl]urea
CID 79686058
pyrrolidin-3-ylcarbamic acid;hydrochloride
CID 141142005
1-cyclohexyl-3-[(3S)-pyrrolidin-3-yl]urea
CID 79685110
N-[1-acetyl-6-(trifluoromethyl)piperidin-3-yl]-2-cyclohexylideneacetamide
CID 128985927
2-(cyclohexen-1-yl)-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 79688799
oxalic acid;pyrrolidin-3-ylcarbamic acid
CID 66616538

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide?
The IUPAC name of 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide (CID 130678830) is 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide.
What is the SMILES notation for 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide?
The canonical SMILES for 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide is O=C(C=C1CCCC1)NC1CCNC1.
What is the InChIKey of 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide?
The InChIKey is OCNANEOJONLDFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c14-11(7-9-3-1-2-4-9)13-10-5-6-12-8-10/h7,10,12H,1-6,8H2,(H,13,14).
What are the key properties of 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide?
2-cyclopentylidene-N-pyrrolidin-3-ylacetamide has a molecular weight of 194.28 g/mol, XLogP of 0.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentylidene-N-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 130678830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).