N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide

C10H19NO3 — CID 71785695

IUPACN-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide
SMILESCC(C)C(=O)NC1CC(O)C(CO)C1
InChIInChI=1S/C10H19NO3/c1-6(2)10(14)11-8-3-7(5-12)9(13)4-8/h6-9,12-13H,3-5H2,1-2H3,(H,11,14)
InChIKeyHBZLVHWPTMECBT-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.11
Rot. Bonds3

About N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide

N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide (PubChem CID 71785695) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide
PubChem CID71785695
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC NameN-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide
SMILESCC(C)C(=O)NC1CC(O)C(CO)C1
InChIInChI=1S/C10H19NO3/c1-6(2)10(14)11-8-3-7(5-12)9(13)4-8/h6-9,12-13H,3-5H2,1-2H3,(H,11,14)
InChIKeyHBZLVHWPTMECBT-UHFFFAOYSA-N
XLogP-0.11
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide?
The IUPAC name of N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide (CID 71785695) is N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide.
What is the SMILES notation for N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide?
The canonical SMILES for N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide is CC(C)C(=O)NC1CC(O)C(CO)C1.
What is the InChIKey of N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide?
The InChIKey is HBZLVHWPTMECBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-6(2)10(14)11-8-3-7(5-12)9(13)4-8/h6-9,12-13H,3-5H2,1-2H3,(H,11,14).
What are the key properties of N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide?
N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide has a molecular weight of 201.27 g/mol, XLogP of -0.11, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-hydroxy-4-(hydroxymethyl)cyclopentyl]-2-methylpropanamide is sourced from PubChem (CID 71785695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).