N-(oxan-2-yloxy)cyclopropanecarboxamide

C9H15NO3 — CID 130685295

IUPACN-(oxan-2-yloxy)cyclopropanecarboxamide
SMILESO=C(NOC1CCCCO1)C1CC1
InChIInChI=1S/C9H15NO3/c11-9(7-4-5-7)10-13-8-3-1-2-6-12-8/h7-8H,1-6H2,(H,10,11)
InChIKeyVAICTYGTKFPWHA-UHFFFAOYSA-N
MW185.22 g/mol
LogP0.97
Rot. Bonds3

About N-(oxan-2-yloxy)cyclopropanecarboxamide

N-(oxan-2-yloxy)cyclopropanecarboxamide (PubChem CID 130685295) has the molecular formula C9H15NO3 and a molecular weight of 185.22 g/mol. Its IUPAC name is N-(oxan-2-yloxy)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(oxan-2-yloxy)cyclopropanecarboxamide
PubChem CID130685295
Molecular FormulaC9H15NO3
Molecular Weight185.22 g/mol
Exact Mass185.11
IUPAC NameN-(oxan-2-yloxy)cyclopropanecarboxamide
SMILESO=C(NOC1CCCCO1)C1CC1
InChIInChI=1S/C9H15NO3/c11-9(7-4-5-7)10-13-8-3-1-2-6-12-8/h7-8H,1-6H2,(H,10,11)
InChIKeyVAICTYGTKFPWHA-UHFFFAOYSA-N
XLogP0.97
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(oxan-2-yloxy)cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R,3R)-3-methyl-N-[(2R)-oxan-2-yl]oxyoxolane-2-carboxamide
CID 97023842
trans-(1R,2R)-2-cyclohexyl-N-[(2R)-oxan-2-yl]oxycyclopropane-1-carboxamide
CID 99716407
(2S)-N-[(2S)-oxan-2-yl]oxy-6-oxaspiro[2.5]octane-2-carboxamide
CID 95972380
(2S)-1-(cyclohexanecarbonyl)-N-[(2S)-oxan-2-yl]oxypyrrolidine-2-carboxamide
CID 95139145
tert-butyl N-(oxan-2-yloxy)carbamate
CID 11790630
(3R)-3-N-[(2S)-oxan-2-yl]oxy-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
CID 94824519
N-(oxan-2-yloxy)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
CID 154859849
(2S)-2-methyl-N-[(2S)-oxan-2-yl]oxypiperidine-1-carboxamide
CID 99718680
1-methyl-1,3-bis(oxan-2-yloxy)urea
CID 19371750
N-(oxan-2-yloxy)hex-5-ynamide
CID 163203741
tert-butyl (4S)-4-(oxan-2-yloxycarbamoyl)-1,3-thiazolidine-3-carboxylate
CID 56800960
(3R)-1-(4-methylbenzoyl)-N-[(2S)-oxan-2-yl]oxypiperidine-3-carboxamide
CID 52828959

Frequently Asked Questions

What is the IUPAC name of N-(oxan-2-yloxy)cyclopropanecarboxamide?
The IUPAC name of N-(oxan-2-yloxy)cyclopropanecarboxamide (CID 130685295) is N-(oxan-2-yloxy)cyclopropanecarboxamide.
What is the SMILES notation for N-(oxan-2-yloxy)cyclopropanecarboxamide?
The canonical SMILES for N-(oxan-2-yloxy)cyclopropanecarboxamide is O=C(NOC1CCCCO1)C1CC1.
What is the InChIKey of N-(oxan-2-yloxy)cyclopropanecarboxamide?
The InChIKey is VAICTYGTKFPWHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO3/c11-9(7-4-5-7)10-13-8-3-1-2-6-12-8/h7-8H,1-6H2,(H,10,11).
What are the key properties of N-(oxan-2-yloxy)cyclopropanecarboxamide?
N-(oxan-2-yloxy)cyclopropanecarboxamide has a molecular weight of 185.22 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-2-yloxy)cyclopropanecarboxamide is sourced from PubChem (CID 130685295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).