2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine

C10H16F2N2O — CID 170144644

IUPAC2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine
SMILESCc1oc(C(C)(C)N(C)C)nc1C(F)F
InChIInChI=1S/C10H16F2N2O/c1-6-7(8(11)12)13-9(15-6)10(2,3)14(4)5/h8H,1-5H3
InChIKeyFPNNNMDTRNMNFO-UHFFFAOYSA-N
MW218.25 g/mol
LogP2.72
Rot. Bonds3

About 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine

2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine (PubChem CID 170144644) has the molecular formula C10H16F2N2O and a molecular weight of 218.25 g/mol. Its IUPAC name is 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine.

Molecular Properties

Compound Name2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine
PubChem CID170144644
Molecular FormulaC10H16F2N2O
Molecular Weight218.25 g/mol
Exact Mass218.12
IUPAC Name2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine
SMILESCc1oc(C(C)(C)N(C)C)nc1C(F)F
InChIInChI=1S/C10H16F2N2O/c1-6-7(8(11)12)13-9(15-6)10(2,3)14(4)5/h8H,1-5H3
InChIKeyFPNNNMDTRNMNFO-UHFFFAOYSA-N
XLogP2.72
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4,5-Trimethyloxazole
CID 30215
2-Ethyl-4,5-dimethyloxazole
CID 62069
2-Isopropyl-4,5-dimethyloxazole
CID 29644
(4,5-Dimethyl-1,3-Oxazol-2-Yl)Methanamine
CID 28293489
1-[(4,5-Dimethyl-1,3-oxazol-2-yl)methyl]-3-(2,2,2-trifluoroethyl)urea
CID 47360646
4,5-Dimethyl-2-(trifluoromethyl)oxazole
CID 14639803
2,4-Dimethyl-5-trifluoromethyloxazole
CID 60019988
2,5-Dimethyl-4-(trifluoromethyl)-1,3-oxazole
CID 59146359
4-Methyl-2-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole
CID 68235767
5-Methyl-2-propan-2-yl-4-(trifluoromethyl)-1,3-oxazole
CID 68235770
4-(Fluoromethyl)-2,5-dimethyl-1,3-oxazole
CID 89058861
2-Ethyl-4-methyl-5-(trifluoromethyl)-1,3-oxazole
CID 91349681

Frequently Asked Questions

What is the IUPAC name of 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine?
The IUPAC name of 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine (CID 170144644) is 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine.
What is the SMILES notation for 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine?
The canonical SMILES for 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine is Cc1oc(C(C)(C)N(C)C)nc1C(F)F.
What is the InChIKey of 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine?
The InChIKey is FPNNNMDTRNMNFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F2N2O/c1-6-7(8(11)12)13-9(15-6)10(2,3)14(4)5/h8H,1-5H3.
What are the key properties of 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine?
2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine has a molecular weight of 218.25 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethyl)-5-methyl-1,3-oxazol-2-yl]-N,N-dimethylpropan-2-amine is sourced from PubChem (CID 170144644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).