(4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine

C15H14N2O — CID 59323724

IUPAC(4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
SMILESNC1=N[C@H](c2ccc(-c3ccccc3)cc2)CO1
InChIInChI=1S/C15H14N2O/c16-15-17-14(10-18-15)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14H,10H2,(H2,16,17)/t14-/m0/s1
InChIKeyVXPAHLKILGDCAD-AWEZNQCLSA-N
MW238.29 g/mol
LogP2.74
Rot. Bonds2

About (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine

(4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine (PubChem CID 59323724) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine.

Molecular Properties

Compound Name(4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
PubChem CID59323724
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name(4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
SMILESNC1=N[C@H](c2ccc(-c3ccccc3)cc2)CO1
InChIInChI=1S/C15H14N2O/c16-15-17-14(10-18-15)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14H,10H2,(H2,16,17)/t14-/m0/s1
InChIKeyVXPAHLKILGDCAD-AWEZNQCLSA-N
XLogP2.74
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(S)-4-((S)-2-Phenylbutyl)-4,5-dihydrooxazol-2-amine
CID 24963286
RO-5263397
CID 56835991
(4S)-4-(2-phenylethyl)-4,5-dihydro-1,3-oxazol-2-amine
CID 59824833
(S)-Rexamino
CID 11116360
(4S)-4,5-Dihydro-4-[(2R)-2-phenylbutyl]-2-oxazolamine
CID 24963287
(4S)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
CID 24966828
(S)-4-Benzyl-4,5-dihydrooxazol-2-amine
CID 54333224
(S)-4-(3-Fluorophenyl)-4,5-dihydrooxazol-2-amine
CID 59323617
(4S)-4-(2-methylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
CID 59323758
(4S)-4-(3-phenylpropyl)-4,5-dihydro-1,3-oxazol-2-amine
CID 59323798
(4S)-4-[(2R)-2-phenylpropyl]-4,5-dihydro-1,3-oxazol-2-amine
CID 59323844
(4S)-4-[(2S)-2-phenylpropyl]-4,5-dihydro-1,3-oxazol-2-amine
CID 59323854

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine?
The IUPAC name of (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine (CID 59323724) is (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine.
What is the SMILES notation for (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine?
The canonical SMILES for (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine is NC1=N[C@H](c2ccc(-c3ccccc3)cc2)CO1.
What is the InChIKey of (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine?
The InChIKey is VXPAHLKILGDCAD-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H14N2O/c16-15-17-14(10-18-15)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14H,10H2,(H2,16,17)/t14-/m0/s1.
What are the key properties of (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine?
(4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine has a molecular weight of 238.29 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(4-phenylphenyl)-4,5-dihydro-1,3-oxazol-2-amine is sourced from PubChem (CID 59323724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).