N,N-diphenyl-1,3-benzoxazol-2-amine

C19H14N2O — CID 101462195

IUPACN,N-diphenyl-1,3-benzoxazol-2-amine
SMILESc1ccc(N(c2ccccc2)c2nc3ccccc3o2)cc1
InChIInChI=1S/C19H14N2O/c1-3-9-15(10-4-1)21(16-11-5-2-6-12-16)19-20-17-13-7-8-14-18(17)22-19/h1-14H
InChIKeyPCPOCUCCOCNTDT-UHFFFAOYSA-N
MW286.33 g/mol
LogP5.30
Rot. Bonds3

About N,N-diphenyl-1,3-benzoxazol-2-amine

N,N-diphenyl-1,3-benzoxazol-2-amine (PubChem CID 101462195) has the molecular formula C19H14N2O and a molecular weight of 286.33 g/mol. Its IUPAC name is N,N-diphenyl-1,3-benzoxazol-2-amine.

Molecular Properties

Compound NameN,N-diphenyl-1,3-benzoxazol-2-amine
PubChem CID101462195
Molecular FormulaC19H14N2O
Molecular Weight286.33 g/mol
Exact Mass286.11
IUPAC NameN,N-diphenyl-1,3-benzoxazol-2-amine
SMILESc1ccc(N(c2ccccc2)c2nc3ccccc3o2)cc1
InChIInChI=1S/C19H14N2O/c1-3-9-15(10-4-1)21(16-11-5-2-6-12-16)19-20-17-13-7-8-14-18(17)22-19/h1-14H
InChIKeyPCPOCUCCOCNTDT-UHFFFAOYSA-N
XLogP5.30
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.33
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-N-triphenylen-2-yl-1,3-benzoxazol-2-amine
CID 166918292
4-N,9-N-bis(1,3-benzoxazol-2-yl)-4-N,9-N-diphenylpyrene-4,9-diamine
CID 174313126
N-dibenzothiophen-4-yl-N-phenyl-1,3-benzoxazol-2-amine
CID 166918024
N-(3-methylbutyl)-N-phenyl-1,3-benzoxazol-2-amine
CID 57475909
N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-[4-(N-[4-(1,3-benzoxazol-2-yl)phenyl]anilino)phenyl]-N-phenylaniline
CID 59707538
N-iodo-N-methyl-1,3-benzoxazol-2-amine
CID 142874451
4-[(E)-2-(1,3-benzoxazol-2-yl)ethenyl]-N,N-diphenylaniline
CID 20692325
N,N-bis[4-(1,3-benzoxazol-2-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 155402925
3-[N-(1,3-benzoxazol-2-yl)anilino]propanethioamide
CID 61033215
N-(2-bromoethyl)-N-ethyl-1,3-benzoxazol-2-amine
CID 80672616
N,N-bis(prop-2-enyl)-1,3-benzoxazol-2-amine
CID 44603809
N-[4-(3a,7a-dihydro-1,3-benzoxazol-2-yl)phenyl]-N-(1,3-benzoxazol-2-yl)-1,3-benzoxazol-2-amine
CID 146340371

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-1,3-benzoxazol-2-amine?
The IUPAC name of N,N-diphenyl-1,3-benzoxazol-2-amine (CID 101462195) is N,N-diphenyl-1,3-benzoxazol-2-amine.
What is the SMILES notation for N,N-diphenyl-1,3-benzoxazol-2-amine?
The canonical SMILES for N,N-diphenyl-1,3-benzoxazol-2-amine is c1ccc(N(c2ccccc2)c2nc3ccccc3o2)cc1.
What is the InChIKey of N,N-diphenyl-1,3-benzoxazol-2-amine?
The InChIKey is PCPOCUCCOCNTDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O/c1-3-9-15(10-4-1)21(16-11-5-2-6-12-16)19-20-17-13-7-8-14-18(17)22-19/h1-14H.
What are the key properties of N,N-diphenyl-1,3-benzoxazol-2-amine?
N,N-diphenyl-1,3-benzoxazol-2-amine has a molecular weight of 286.33 g/mol, XLogP of 5.30, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-1,3-benzoxazol-2-amine is sourced from PubChem (CID 101462195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).