N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide

C9H15NO3 — CID 103849552

IUPACN-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide
SMILESO=C(NCC1(O)CCOC1)C1CC1
InChIInChI=1S/C9H15NO3/c11-8(7-1-2-7)10-5-9(12)3-4-13-6-9/h7,12H,1-6H2,(H,10,11)
InChIKeyQOOFYACBDKKJBZ-UHFFFAOYSA-N
MW185.22 g/mol
LogP-0.34
Rot. Bonds3

About N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide

N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide (PubChem CID 103849552) has the molecular formula C9H15NO3 and a molecular weight of 185.22 g/mol. Its IUPAC name is N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide
PubChem CID103849552
Molecular FormulaC9H15NO3
Molecular Weight185.22 g/mol
Exact Mass185.11
IUPAC NameN-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide
SMILESO=C(NCC1(O)CCOC1)C1CC1
InChIInChI=1S/C9H15NO3/c11-8(7-1-2-7)10-5-9(12)3-4-13-6-9/h7,12H,1-6H2,(H,10,11)
InChIKeyQOOFYACBDKKJBZ-UHFFFAOYSA-N
XLogP-0.34
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide (CID 103849552) is N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide is O=C(NCC1(O)CCOC1)C1CC1.
What is the InChIKey of N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide?
The InChIKey is QOOFYACBDKKJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO3/c11-8(7-1-2-7)10-5-9(12)3-4-13-6-9/h7,12H,1-6H2,(H,10,11).
What are the key properties of N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide?
N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide has a molecular weight of 185.22 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxyoxolan-3-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 103849552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).