4-(2,2,3-trimethylcyclopentyl)butanamide

C12H23NO — CID 59331131

IUPAC4-(2,2,3-trimethylcyclopentyl)butanamide
SMILESCC1CCC(CCCC(N)=O)C1(C)C
InChIInChI=1S/C12H23NO/c1-9-7-8-10(12(9,2)3)5-4-6-11(13)14/h9-10H,4-8H2,1-3H3,(H2,13,14)
InChIKeyAHUDABBLXXYHKI-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.71
Rot. Bonds4

About 4-(2,2,3-trimethylcyclopentyl)butanamide

4-(2,2,3-trimethylcyclopentyl)butanamide (PubChem CID 59331131) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 4-(2,2,3-trimethylcyclopentyl)butanamide.

Molecular Properties

Compound Name4-(2,2,3-trimethylcyclopentyl)butanamide
PubChem CID59331131
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name4-(2,2,3-trimethylcyclopentyl)butanamide
SMILESCC1CCC(CCCC(N)=O)C1(C)C
InChIInChI=1S/C12H23NO/c1-9-7-8-10(12(9,2)3)5-4-6-11(13)14/h9-10H,4-8H2,1-3H3,(H2,13,14)
InChIKeyAHUDABBLXXYHKI-UHFFFAOYSA-N
XLogP2.71
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2,3-trimethylcyclopentyl)butanamide?
The IUPAC name of 4-(2,2,3-trimethylcyclopentyl)butanamide (CID 59331131) is 4-(2,2,3-trimethylcyclopentyl)butanamide.
What is the SMILES notation for 4-(2,2,3-trimethylcyclopentyl)butanamide?
The canonical SMILES for 4-(2,2,3-trimethylcyclopentyl)butanamide is CC1CCC(CCCC(N)=O)C1(C)C.
What is the InChIKey of 4-(2,2,3-trimethylcyclopentyl)butanamide?
The InChIKey is AHUDABBLXXYHKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9-7-8-10(12(9,2)3)5-4-6-11(13)14/h9-10H,4-8H2,1-3H3,(H2,13,14).
What are the key properties of 4-(2,2,3-trimethylcyclopentyl)butanamide?
4-(2,2,3-trimethylcyclopentyl)butanamide has a molecular weight of 197.32 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2,3-trimethylcyclopentyl)butanamide is sourced from PubChem (CID 59331131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).