N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide

C14H25NO2 — CID 15883436

IUPACN-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NCCCCC(=O)C1CCC1
InChIInChI=1S/C14H25NO2/c1-14(2,3)13(17)15-10-5-4-9-12(16)11-7-6-8-11/h11H,4-10H2,1-3H3,(H,15,17)
InChIKeyBAXOMZRAIKGHPH-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.69
Rot. Bonds6

About N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide

N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide (PubChem CID 15883436) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide
PubChem CID15883436
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC NameN-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NCCCCC(=O)C1CCC1
InChIInChI=1S/C14H25NO2/c1-14(2,3)13(17)15-10-5-4-9-12(16)11-7-6-8-11/h11H,4-10H2,1-3H3,(H,15,17)
InChIKeyBAXOMZRAIKGHPH-UHFFFAOYSA-N
XLogP2.69
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,8-di(cyclobutyl)octane-1,8-dione
CID 70972585
6-[(2-cyclopentyl-2-methylpropanoyl)amino]hexanoic acid
CID 120522460
tert-butyl N-(3-cyclobutyl-3-oxopropyl)carbamate
CID 66787499
1-cyclopentyl-5,5-dimethylhexan-1-one
CID 59118963
N-[3-(cyclopropylamino)propyl]-2,2-dimethylpropanamide
CID 43596452
1-cyclobutylheptane-1,6-dione
CID 59531069
1-cyclobutyl-3-(ethylamino)propan-1-one
CID 116565933
2,2-dimethyl-N-tetradecylpropanamide
CID 11220230
1-cyclobutylnonane-1,8-dione
CID 70928486
1-cyclobutyldodecan-1-one
CID 115811550
1-cyclopropyl-6,6-dimethylheptane-1,5-dione
CID 123777763
N-[4-[[1-(cyclohexanecarbonyl)piperidin-4-yl]amino]-4-oxobutyl]-2,2-dimethylpropanamide
CID 55706617

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide (CID 15883436) is N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)NCCCCC(=O)C1CCC1.
What is the InChIKey of N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide?
The InChIKey is BAXOMZRAIKGHPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-14(2,3)13(17)15-10-5-4-9-12(16)11-7-6-8-11/h11H,4-10H2,1-3H3,(H,15,17).
What are the key properties of N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide?
N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide has a molecular weight of 239.36 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclobutyl-5-oxopentyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 15883436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).