N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide

C13H21NO — CID 10856679

IUPACN-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC(C)(C)C1C=CC=C1
InChIInChI=1S/C13H21NO/c1-12(2,3)11(15)14-13(4,5)10-8-6-7-9-10/h6-10H,1-5H3,(H,14,15)
InChIKeyUBTHSULSAQIDLM-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.67
Rot. Bonds2

About N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide

N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide (PubChem CID 10856679) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide
PubChem CID10856679
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC NameN-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC(C)(C)C1C=CC=C1
InChIInChI=1S/C13H21NO/c1-12(2,3)11(15)14-13(4,5)10-8-6-7-9-10/h6-10H,1-5H3,(H,14,15)
InChIKeyUBTHSULSAQIDLM-UHFFFAOYSA-N
XLogP2.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide 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

N-(1-cyclopenta-2,4-dien-1-ylideneethyl)-2,2-dimethylpropanamide
CID 67558352
2-methyl-N-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)propanamide
CID 22239886
N-(1-ethenylcyclohexa-2,4-dien-1-yl)acetamide
CID 22256022
N-(1,6-dimethylcyclohexa-2,4-dien-1-yl)prop-2-enamide
CID 70619410
N-tert-butyl-4-methyl-2-propan-2-ylpent-3-enamide
CID 89150845
N-[(3E,5E)-2,7-dimethyl-3-[(Z)-prop-1-enyl]octa-3,5,7-trien-2-yl]acetamide
CID 89150927
3-methyl-N-(1-propan-2-ylcyclopent-3-en-1-yl)butanamide
CID 89691952
3-methyl-N-(1-methylcyclopent-3-en-1-yl)butanamide
CID 89694397
2-methyl-N-(2-methylhepta-3,5-dien-2-yl)propanamide
CID 91261547
2-methyl-N-(2,3,4,5-tetramethylhepta-3,5-dien-2-yl)propanamide
CID 91465696
(4Z)-N-tert-butyldeca-4,6-dienamide
CID 117720960
(4E)-N-tert-butyldeca-4,6-dienamide
CID 117721139

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide?
The IUPAC name of N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide (CID 10856679) is N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)NC(C)(C)C1C=CC=C1.
What is the InChIKey of N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide?
The InChIKey is UBTHSULSAQIDLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-12(2,3)11(15)14-13(4,5)10-8-6-7-9-10/h6-10H,1-5H3,(H,14,15).
What are the key properties of N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide?
N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide has a molecular weight of 207.32 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide is sourced from PubChem (CID 10856679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).