2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide

C13H23NO3 — CID 103954051

IUPAC2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
SMILESO=C(CC1CCCC1)NC1(CO)CCOCC1
InChIInChI=1S/C13H23NO3/c15-10-13(5-7-17-8-6-13)14-12(16)9-11-3-1-2-4-11/h11,15H,1-10H2,(H,14,16)
InChIKeyZRLHDIKFRPQLBI-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.22
Rot. Bonds4

About 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide

2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide (PubChem CID 103954051) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
PubChem CID103954051
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC Name2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
SMILESO=C(CC1CCCC1)NC1(CO)CCOCC1
InChIInChI=1S/C13H23NO3/c15-10-13(5-7-17-8-6-13)14-12(16)9-11-3-1-2-4-11/h11,15H,1-10H2,(H,14,16)
InChIKeyZRLHDIKFRPQLBI-UHFFFAOYSA-N
XLogP1.22
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The IUPAC name of 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide (CID 103954051) is 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide is O=C(CC1CCCC1)NC1(CO)CCOCC1.
What is the InChIKey of 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The InChIKey is ZRLHDIKFRPQLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c15-10-13(5-7-17-8-6-13)14-12(16)9-11-3-1-2-4-11/h11,15H,1-10H2,(H,14,16).
What are the key properties of 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide has a molecular weight of 241.33 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide is sourced from PubChem (CID 103954051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).