N-(3-methylbutyl)cyclobutanecarboxamide

C10H19NO — CID 58394478

IUPACN-(3-methylbutyl)cyclobutanecarboxamide
SMILESCC(C)CCNC(=O)C1CCC1
InChIInChI=1S/C10H19NO/c1-8(2)6-7-11-10(12)9-4-3-5-9/h8-9H,3-7H2,1-2H3,(H,11,12)
InChIKeyIFSZTRLEJBOOHQ-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.95
Rot. Bonds4

About N-(3-methylbutyl)cyclobutanecarboxamide

N-(3-methylbutyl)cyclobutanecarboxamide (PubChem CID 58394478) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-(3-methylbutyl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(3-methylbutyl)cyclobutanecarboxamide
PubChem CID58394478
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-(3-methylbutyl)cyclobutanecarboxamide
SMILESCC(C)CCNC(=O)C1CCC1
InChIInChI=1S/C10H19NO/c1-8(2)6-7-11-10(12)9-4-3-5-9/h8-9H,3-7H2,1-2H3,(H,11,12)
InChIKeyIFSZTRLEJBOOHQ-UHFFFAOYSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)cyclobutanecarboxamide?
The IUPAC name of N-(3-methylbutyl)cyclobutanecarboxamide (CID 58394478) is N-(3-methylbutyl)cyclobutanecarboxamide.
What is the SMILES notation for N-(3-methylbutyl)cyclobutanecarboxamide?
The canonical SMILES for N-(3-methylbutyl)cyclobutanecarboxamide is CC(C)CCNC(=O)C1CCC1.
What is the InChIKey of N-(3-methylbutyl)cyclobutanecarboxamide?
The InChIKey is IFSZTRLEJBOOHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-8(2)6-7-11-10(12)9-4-3-5-9/h8-9H,3-7H2,1-2H3,(H,11,12).
What are the key properties of N-(3-methylbutyl)cyclobutanecarboxamide?
N-(3-methylbutyl)cyclobutanecarboxamide has a molecular weight of 169.27 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)cyclobutanecarboxamide is sourced from PubChem (CID 58394478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).