N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide

C10H19NO — CID 135039134

IUPACN-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide
SMILESCC(=O)N[C@H]1CC[C@@H](C)C1(C)C
InChIInChI=1S/C10H19NO/c1-7-5-6-9(10(7,3)4)11-8(2)12/h7,9H,5-6H2,1-4H3,(H,11,12)/t7-,9+/m1/s1
InChIKeyIMHYZKYFGRIFIV-APPZFPTMSA-N
MW169.27 g/mol
LogP1.95
Rot. Bonds1

About N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide

N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide (PubChem CID 135039134) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide.

Molecular Properties

Compound NameN-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide
PubChem CID135039134
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide
SMILESCC(=O)N[C@H]1CC[C@@H](C)C1(C)C
InChIInChI=1S/C10H19NO/c1-7-5-6-9(10(7,3)4)11-8(2)12/h7,9H,5-6H2,1-4H3,(H,11,12)/t7-,9+/m1/s1
InChIKeyIMHYZKYFGRIFIV-APPZFPTMSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
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-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide?
The IUPAC name of N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide (CID 135039134) is N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide.
What is the SMILES notation for N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide?
The canonical SMILES for N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide is CC(=O)N[C@H]1CC[C@@H](C)C1(C)C.
What is the InChIKey of N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide?
The InChIKey is IMHYZKYFGRIFIV-APPZFPTMSA-N. The full InChI is InChI=1S/C10H19NO/c1-7-5-6-9(10(7,3)4)11-8(2)12/h7,9H,5-6H2,1-4H3,(H,11,12)/t7-,9+/m1/s1.
What are the key properties of N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide?
N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide has a molecular weight of 169.27 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,3R)-2,2,3-trimethylcyclopentyl]acetamide is sourced from PubChem (CID 135039134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).