5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide

C12H19NO2 — CID 15548451

IUPAC5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide
SMILESCC(C)N(C(=O)C1=CCCC1=O)C(C)C
InChIInChI=1S/C12H19NO2/c1-8(2)13(9(3)4)12(15)10-6-5-7-11(10)14/h6,8-9H,5,7H2,1-4H3
InChIKeyMUDHJDWYQIKFEY-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.92
Rot. Bonds3

About 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide

5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide (PubChem CID 15548451) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide.

Molecular Properties

Compound Name5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide
PubChem CID15548451
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide
SMILESCC(C)N(C(=O)C1=CCCC1=O)C(C)C
InChIInChI=1S/C12H19NO2/c1-8(2)13(9(3)4)12(15)10-6-5-7-11(10)14/h6,8-9H,5,7H2,1-4H3
InChIKeyMUDHJDWYQIKFEY-UHFFFAOYSA-N
XLogP1.92
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_4', 'substructure': 'N/A'}

Analyze 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-N,N-di(propan-2-yl)-2-propylhex-2-enamide
CID 101466460
(E)-N,N,5-triethyl-3,6-dioxooct-4-enamide
CID 11230533
3,3-dimethyl-5-oxo-N-propan-2-ylcyclopentene-1-carboxamide
CID 11830330
N,N-diethyl-5-oxocyclopentene-1-carboxamide
CID 15548449
Piperidine, 1-[(5-oxo-1-cyclopenten-1-YL)carbonyl]-
CID 15548450
6-oxo-N,N-di(propan-2-yl)cyclohexene-1-carboxamide
CID 15548452
2-(Piperidine-1-carbonyl)cyclohex-2-en-1-one
CID 15548453
N,3,3-trimethyl-5-oxo-N-prop-2-enylcyclopentene-1-carboxamide
CID 15548462
N-tert-butyl-3,3-dimethyl-5-oxo-N-prop-2-enylcyclopentene-1-carboxamide
CID 15548463
N,3,3-trimethyl-5-oxo-N-pent-4-enylcyclopentene-1-carboxamide
CID 101055440
N-tert-butyl-N,3,3-trimethyl-5-oxocyclopentene-1-carboxamide
CID 101055450
3,3-dimethyl-5-oxo-N,N-bis(prop-2-enyl)cyclopentene-1-carboxamide
CID 101994280

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide?
The IUPAC name of 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide (CID 15548451) is 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide.
What is the SMILES notation for 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide?
The canonical SMILES for 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide is CC(C)N(C(=O)C1=CCCC1=O)C(C)C.
What is the InChIKey of 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide?
The InChIKey is MUDHJDWYQIKFEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-8(2)13(9(3)4)12(15)10-6-5-7-11(10)14/h6,8-9H,5,7H2,1-4H3.
What are the key properties of 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide?
5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide has a molecular weight of 209.29 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N,N-di(propan-2-yl)cyclopentene-1-carboxamide is sourced from PubChem (CID 15548451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).