1-decylcyclobutane-1-carboxamide

C15H29NO — CID 10037267

IUPAC1-decylcyclobutane-1-carboxamide
SMILESCCCCCCCCCCC1(C(N)=O)CCC1
InChIInChI=1S/C15H29NO/c1-2-3-4-5-6-7-8-9-11-15(14(16)17)12-10-13-15/h2-13H2,1H3,(H2,16,17)
InChIKeyDBILTQXRSXIMLX-UHFFFAOYSA-N
MW239.40 g/mol
LogP4.17
Rot. Bonds10

About 1-decylcyclobutane-1-carboxamide

1-decylcyclobutane-1-carboxamide (PubChem CID 10037267) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-decylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-decylcyclobutane-1-carboxamide
PubChem CID10037267
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-decylcyclobutane-1-carboxamide
SMILESCCCCCCCCCCC1(C(N)=O)CCC1
InChIInChI=1S/C15H29NO/c1-2-3-4-5-6-7-8-9-11-15(14(16)17)12-10-13-15/h2-13H2,1H3,(H2,16,17)
InChIKeyDBILTQXRSXIMLX-UHFFFAOYSA-N
XLogP4.17
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(4-amino-4-oxobutyl)cycloheptane-1-carboxamide;1-(8-amino-8-oxooctyl)cycloheptane-1-carboxamide;decanamide
CID 70614792
1-butylcyclohexane-1-carboxamide
CID 57018178
1-(10-amino-10-oxodecyl)cycloheptane-1-carboxamide
CID 23208382
1-octylcyclononane-1-carboxylic acid
CID 71245674
1-(8-amino-8-oxooctyl)cycloundecane-1-carboxamide
CID 66641260
1-nonylcyclooctane-1-carboxylic acid
CID 80609308
heptyl 1-heptylcyclohexane-1-carboxylate
CID 118023619
1-nonylcyclopropane-1-carboxylic acid
CID 54124337
1-(1-octylcyclopropyl)ethanone
CID 22042371
1-pentylcyclohexane-1-carboxylate
CID 22407698
1-(4-amino-4-oxobutyl)cyclododecane-1-carboxamide
CID 67540798
1-butylcyclobutane-1-carbothioamide
CID 145047182

Frequently Asked Questions

What is the IUPAC name of 1-decylcyclobutane-1-carboxamide?
The IUPAC name of 1-decylcyclobutane-1-carboxamide (CID 10037267) is 1-decylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-decylcyclobutane-1-carboxamide?
The canonical SMILES for 1-decylcyclobutane-1-carboxamide is CCCCCCCCCCC1(C(N)=O)CCC1.
What is the InChIKey of 1-decylcyclobutane-1-carboxamide?
The InChIKey is DBILTQXRSXIMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-2-3-4-5-6-7-8-9-11-15(14(16)17)12-10-13-15/h2-13H2,1H3,(H2,16,17).
What are the key properties of 1-decylcyclobutane-1-carboxamide?
1-decylcyclobutane-1-carboxamide has a molecular weight of 239.40 g/mol, XLogP of 4.17, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decylcyclobutane-1-carboxamide is sourced from PubChem (CID 10037267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).