(3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone

C14H17NO2 — CID 116579490

IUPAC(3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone
SMILESNC1(C(=O)C2CC2c2ccccc2)CCOC1
InChIInChI=1S/C14H17NO2/c15-14(6-7-17-9-14)13(16)12-8-11(12)10-4-2-1-3-5-10/h1-5,11-12H,6-9,15H2
InChIKeyUDVYDXXCTOVMON-UHFFFAOYSA-N
MW231.29 g/mol
LogP1.48
Rot. Bonds3

About (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone

(3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone (PubChem CID 116579490) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name(3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone
PubChem CID116579490
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name(3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone
SMILESNC1(C(=O)C2CC2c2ccccc2)CCOC1
InChIInChI=1S/C14H17NO2/c15-14(6-7-17-9-14)13(16)12-8-11(12)10-4-2-1-3-5-10/h1-5,11-12H,6-9,15H2
InChIKeyUDVYDXXCTOVMON-UHFFFAOYSA-N
XLogP1.48
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone 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

cis-(1R,2S)-2-phenylcyclopropane-1-carboxylic acid
CID 778516
(3-aminooxolan-3-yl)-(4-phenylphenyl)methanone
CID 116579512
ethane;2-phenylcyclopropane-1-carboxylic acid
CID 91570346
3-amino-2-methyl-1-(2-phenylcyclopropyl)propan-1-one
CID 116564403
trans-methyl (1S,2S)-2-phenylcyclopropane-1-carboxylate
CID 642984
N-methoxy-2-phenylcyclopropane-1-carboxamide
CID 72524749
2,2-dimethoxy-1-(2-phenylcyclopropyl)ethanone
CID 116517110
trans-(1S,2S)-N-[(1-aminocyclohexyl)methyl]-2-phenylcyclopropane-1-carboxamide
CID 99776033
2-chloro-1-[(1S,2R)-2-phenylcyclopropyl]ethanone
CID 164769669
(3-aminooxolan-3-yl)-(oxolan-3-yl)methanone
CID 116579508
(3S)-3-aminooxolane-3-carboxamide
CID 96640573
3-amino-N-(2-anilino-2-oxoethyl)-N-methyloxolane-3-carboxamide
CID 64892555

Frequently Asked Questions

What is the IUPAC name of (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone?
The IUPAC name of (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone (CID 116579490) is (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone.
What is the SMILES notation for (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone?
The canonical SMILES for (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone is NC1(C(=O)C2CC2c2ccccc2)CCOC1.
What is the InChIKey of (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone?
The InChIKey is UDVYDXXCTOVMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c15-14(6-7-17-9-14)13(16)12-8-11(12)10-4-2-1-3-5-10/h1-5,11-12H,6-9,15H2.
What are the key properties of (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone?
(3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone has a molecular weight of 231.29 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminooxolan-3-yl)-(2-phenylcyclopropyl)methanone is sourced from PubChem (CID 116579490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).