N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide

C13H16ClNO2 — CID 39087895

IUPACN-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide
SMILESO=C(CC[C@H]1CCCO1)Nc1ccccc1Cl
InChIInChI=1S/C13H16ClNO2/c14-11-5-1-2-6-12(11)15-13(16)8-7-10-4-3-9-17-10/h1-2,5-6,10H,3-4,7-9H2,(H,15,16)/t10-/m1/s1
InChIKeyMWJMOVUYRJFDIO-SNVBAGLBSA-N
MW253.73 g/mol
LogP3.24
Rot. Bonds4

About N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide

N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide (PubChem CID 39087895) has the molecular formula C13H16ClNO2 and a molecular weight of 253.73 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide
PubChem CID39087895
Molecular FormulaC13H16ClNO2
Molecular Weight253.73 g/mol
Exact Mass253.09
IUPAC NameN-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide
SMILESO=C(CC[C@H]1CCCO1)Nc1ccccc1Cl
InChIInChI=1S/C13H16ClNO2/c14-11-5-1-2-6-12(11)15-13(16)8-7-10-4-3-9-17-10/h1-2,5-6,10H,3-4,7-9H2,(H,15,16)/t10-/m1/s1
InChIKeyMWJMOVUYRJFDIO-SNVBAGLBSA-N
XLogP3.24
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.73
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-2-methylphenyl)-3-(oxolan-2-yl)propanamide
CID 42956717
N-(5-amino-2-chlorophenyl)-3-(oxolan-2-yl)propanamide
CID 65157307
N-(2-chloro-5-iodophenyl)-3-(oxolan-2-yl)propanamide
CID 113255393
N-[2-(chloromethyl)phenyl]-3-(oxan-2-yl)propanamide
CID 114298345
N-[2-(ethylaminomethyl)phenyl]-3-(oxolan-2-yl)propanamide
CID 65160577
N-(4-chloro-3-pyridinyl)-3-(oxan-2-yl)propanamide
CID 103745081
N-[2-methyl-3-[3-(oxolan-2-yl)propanoylamino]phenyl]benzamide
CID 87028458
N-(2-bromo-4-chlorophenyl)-3-(oxolan-2-yl)propanamide
CID 81027186
N-tert-butyl-2-[3-[(2S)-oxolan-2-yl]propanoylamino]benzamide
CID 94642296
3-[(2S)-oxolan-2-yl]-N-pyridin-2-ylpropanamide
CID 51938440
N-(3-chloro-4-methylphenyl)-3-(oxolan-2-yl)propanamide
CID 42956710
3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide
CID 65154594

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide?
The IUPAC name of N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide (CID 39087895) is N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide?
The canonical SMILES for N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide is O=C(CC[C@H]1CCCO1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide?
The InChIKey is MWJMOVUYRJFDIO-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H16ClNO2/c14-11-5-1-2-6-12(11)15-13(16)8-7-10-4-3-9-17-10/h1-2,5-6,10H,3-4,7-9H2,(H,15,16)/t10-/m1/s1.
What are the key properties of N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide?
N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide has a molecular weight of 253.73 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide is sourced from PubChem (CID 39087895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).