N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine

C18H18N2O — CID 101273350

IUPACN,4-dibenzyl-N-methyl-1,3-oxazol-2-amine
SMILESCN(Cc1ccccc1)c1nc(Cc2ccccc2)co1
InChIInChI=1S/C18H18N2O/c1-20(13-16-10-6-3-7-11-16)18-19-17(14-21-18)12-15-8-4-2-5-9-15/h2-11,14H,12-13H2,1H3
InChIKeyXCLYIWHPFOEBKO-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.90
Rot. Bonds5

About N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine

N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine (PubChem CID 101273350) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN,4-dibenzyl-N-methyl-1,3-oxazol-2-amine
PubChem CID101273350
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN,4-dibenzyl-N-methyl-1,3-oxazol-2-amine
SMILESCN(Cc1ccccc1)c1nc(Cc2ccccc2)co1
InChIInChI=1S/C18H18N2O/c1-20(13-16-10-6-3-7-11-16)18-19-17(14-21-18)12-15-8-4-2-5-9-15/h2-11,14H,12-13H2,1H3
InChIKeyXCLYIWHPFOEBKO-UHFFFAOYSA-N
XLogP3.90
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Acetamide, N-(4-phenyl-2-oxazolyl)-
CID 37199
4-Phenyl-1,3-oxazol-2-amine
CID 520605
N-[[3-[2-[(N'-butylcarbamimidoyl)amino]-1,3-oxazol-4-yl]phenyl]methyl]acetamide
CID 11099546
N-Butyl-N-(4-methyl-1,3-oxazol-2-yl)-2-phenylacetamide
CID 12556859
2-(N-Butyl-isobutyramido)-4-phenyloxazole
CID 12556919
N-Butyl-N-[4-(4-chlorophenyl)-1,3-oxazol-2-YL]-2-methylpropanamide
CID 12556920
3-[Amino-(4-phenyl-1,3-oxazol-2-yl)amino]propanenitrile
CID 13371069
2-(4-Phenyl-1,3-oxazol-2-yl)guanidine
CID 44367488
(E)-3-phenyl-N-(4-phenyl-1,3-oxazol-2-yl)prop-2-enamide
CID 56930625
(E)-N-[4-(4-methylphenyl)-1,3-oxazol-2-yl]-3-phenylprop-2-enamide
CID 56930626
4-[4-(Phenylmethyl)phenyl]-1,3-oxazol-2-amine
CID 163348709
N,N-diethyl-5-methyl-4-phenyl-1,3-oxazol-2-amine
CID 208198

Frequently Asked Questions

What is the IUPAC name of N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine?
The IUPAC name of N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine (CID 101273350) is N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine.
What is the SMILES notation for N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine?
The canonical SMILES for N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine is CN(Cc1ccccc1)c1nc(Cc2ccccc2)co1.
What is the InChIKey of N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine?
The InChIKey is XCLYIWHPFOEBKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-20(13-16-10-6-3-7-11-16)18-19-17(14-21-18)12-15-8-4-2-5-9-15/h2-11,14H,12-13H2,1H3.
What are the key properties of N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine?
N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine has a molecular weight of 278.36 g/mol, XLogP of 3.90, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dibenzyl-N-methyl-1,3-oxazol-2-amine is sourced from PubChem (CID 101273350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).