2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole

C19H23FN2O — CID 124985322

IUPAC2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole
SMILESFc1cccc(Cc2cnc([C@@H]3CCCN(CC4CC4)C3)o2)c1
InChIInChI=1S/C19H23FN2O/c20-17-5-1-3-15(9-17)10-18-11-21-19(23-18)16-4-2-8-22(13-16)12-14-6-7-14/h1,3,5,9,11,14,16H,2,4,6-8,10,12-13H2/t16-/m1/s1
InChIKeyNQYRBWBRRFDEMP-MRXNPFEDSA-N
MW314.40 g/mol
LogP3.99
Rot. Bonds5

About 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole

2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole (PubChem CID 124985322) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole.

Molecular Properties

Compound Name2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole
PubChem CID124985322
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole
SMILESFc1cccc(Cc2cnc([C@@H]3CCCN(CC4CC4)C3)o2)c1
InChIInChI=1S/C19H23FN2O/c20-17-5-1-3-15(9-17)10-18-11-21-19(23-18)16-4-2-8-22(13-16)12-14-6-7-14/h1,3,5,9,11,14,16H,2,4,6-8,10,12-13H2/t16-/m1/s1
InChIKeyNQYRBWBRRFDEMP-MRXNPFEDSA-N
XLogP3.99
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole 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

2-[(2S)-1-(cyclopropylmethyl)pyrrolidin-2-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole
CID 124967184
5-[(3-fluorophenyl)methyl]-2-[(3S)-1-methylsulfonylpyrrolidin-3-yl]-1,3-oxazole
CID 124960502
2-[(2R)-1-cyclopentylpyrrolidin-2-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole
CID 124956667
6-[(3S)-3-[5-[(3-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidine-1-carbonyl]-1H-pyridin-2-one
CID 124964915
[(3S)-3-[5-[(3-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]methanone
CID 125017531
1-[2-[(3R)-3-[5-[(3-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-oxoethyl]pyrimidin-2-one
CID 124956590
4-[3-[5-[(3-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidine-1-carbonyl]-6-methyl-1H-pyrimidin-2-one
CID 110119966
1-[(3R)-3-[5-[(3-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-2-(4-methylphenoxy)ethanone
CID 129457194
(6-benzyl-3-pyridinyl)-[(3R)-3-[5-[(3-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone
CID 125000734
[(3S)-3-[5-[(3-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]-[2-[(4-fluorophenyl)methyl]-4-pyridinyl]methanone
CID 129453940
2-(3,5-dimethylpyrazol-1-yl)-1-[(3S)-3-[5-[(3-fluorophenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]ethanone
CID 125023481
5-[(3-fluorophenyl)methyl]-2-[(3R)-1-(6-methylpyrimidin-4-yl)pyrrolidin-3-yl]-1,3-oxazole
CID 124989778

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole?
The IUPAC name of 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole (CID 124985322) is 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole.
What is the SMILES notation for 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole?
The canonical SMILES for 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole is Fc1cccc(Cc2cnc([C@@H]3CCCN(CC4CC4)C3)o2)c1.
What is the InChIKey of 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole?
The InChIKey is NQYRBWBRRFDEMP-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H23FN2O/c20-17-5-1-3-15(9-17)10-18-11-21-19(23-18)16-4-2-8-22(13-16)12-14-6-7-14/h1,3,5,9,11,14,16H,2,4,6-8,10,12-13H2/t16-/m1/s1.
What are the key properties of 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole?
2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole has a molecular weight of 314.40 g/mol, XLogP of 3.99, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-1-(cyclopropylmethyl)piperidin-3-yl]-5-[(3-fluorophenyl)methyl]-1,3-oxazole is sourced from PubChem (CID 124985322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).