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

C11H19NO3 — CID 104630587

IUPAC2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
SMILESO=C(CC1CC1)NC1(CO)CCOCC1
InChIInChI=1S/C11H19NO3/c13-8-11(3-5-15-6-4-11)12-10(14)7-9-1-2-9/h9,13H,1-8H2,(H,12,14)
InChIKeyMHAAFASDGZSGIX-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.44
Rot. Bonds4

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

2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide (PubChem CID 104630587) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
PubChem CID104630587
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
SMILESO=C(CC1CC1)NC1(CO)CCOCC1
InChIInChI=1S/C11H19NO3/c13-8-11(3-5-15-6-4-11)12-10(14)7-9-1-2-9/h9,13H,1-8H2,(H,12,14)
InChIKeyMHAAFASDGZSGIX-UHFFFAOYSA-N
XLogP0.44
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4,4,4-trifluoro-N-[4-(hydroxymethyl)oxan-4-yl]butanamide
CID 113435072
N-[4-(hydroxymethyl)oxan-4-yl]propanamide
CID 103954267
N-[4-(hydroxymethyl)oxan-4-yl]-2-methylpentanamide
CID 103954342
N-(1-hydroxy-2-methylpropan-2-yl)oxane-4-carboxamide
CID 43393242
N-[3-(hydroxymethyl)pentan-3-yl]oxane-4-carboxamide
CID 62516888
N-[3-(hydroxymethyl)pentan-3-yl]-2-methylcyclopropane-1-carboxamide
CID 62516897
2-cyclopropyl-N-[3-(hydroxymethyl)pentan-3-yl]acetamide
CID 62519766
N-(1-hydroxy-2-methylbutan-2-yl)-2-methylcyclopropane-1-carboxamide
CID 64556016
2-cyclopropyl-N-(1-hydroxy-2-methylbutan-2-yl)acetamide
CID 64556018
N-(1-hydroxy-2-methylbutan-2-yl)oxane-4-carboxamide
CID 64556562
N-(1-hydroxy-2-methylpropan-2-yl)-3-(oxan-4-yl)propanamide
CID 84578784
N-[4-(hydroxymethyl)oxan-4-yl]-3-methylpentanamide
CID 103526863

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The IUPAC name of 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide (CID 104630587) is 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide.
What is the SMILES notation for 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The canonical SMILES for 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide is O=C(CC1CC1)NC1(CO)CCOCC1.
What is the InChIKey of 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The InChIKey is MHAAFASDGZSGIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c13-8-11(3-5-15-6-4-11)12-10(14)7-9-1-2-9/h9,13H,1-8H2,(H,12,14).
What are the key properties of 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide has a molecular weight of 213.28 g/mol, XLogP of 0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[4-(hydroxymethyl)oxan-4-yl]acetamide is sourced from PubChem (CID 104630587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).