N-prop-2-enylcyclopentanecarboxamide

C9H15NO — CID 4613490

IUPACN-prop-2-enylcyclopentanecarboxamide
SMILESC=CCNC(=O)C1CCCC1
InChIInChI=1S/C9H15NO/c1-2-7-10-9(11)8-5-3-4-6-8/h2,8H,1,3-7H2,(H,10,11)
InChIKeyVDCDOQPIDBIQLL-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.48
Rot. Bonds3

About N-prop-2-enylcyclopentanecarboxamide

N-prop-2-enylcyclopentanecarboxamide (PubChem CID 4613490) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-prop-2-enylcyclopentanecarboxamide.

Molecular Properties

Compound NameN-prop-2-enylcyclopentanecarboxamide
PubChem CID4613490
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-prop-2-enylcyclopentanecarboxamide
SMILESC=CCNC(=O)C1CCCC1
InChIInChI=1S/C9H15NO/c1-2-7-10-9(11)8-5-3-4-6-8/h2,8H,1,3-7H2,(H,10,11)
InChIKeyVDCDOQPIDBIQLL-UHFFFAOYSA-N
XLogP1.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.48
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-prop-2-enylcyclopentanecarboxamide?
The IUPAC name of N-prop-2-enylcyclopentanecarboxamide (CID 4613490) is N-prop-2-enylcyclopentanecarboxamide.
What is the SMILES notation for N-prop-2-enylcyclopentanecarboxamide?
The canonical SMILES for N-prop-2-enylcyclopentanecarboxamide is C=CCNC(=O)C1CCCC1.
What is the InChIKey of N-prop-2-enylcyclopentanecarboxamide?
The InChIKey is VDCDOQPIDBIQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-2-7-10-9(11)8-5-3-4-6-8/h2,8H,1,3-7H2,(H,10,11).
What are the key properties of N-prop-2-enylcyclopentanecarboxamide?
N-prop-2-enylcyclopentanecarboxamide has a molecular weight of 153.22 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enylcyclopentanecarboxamide is sourced from PubChem (CID 4613490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).