N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide

C14H14N2O2 — CID 47413926

IUPACN-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide
SMILESCN(C(=O)c1ccc(-c2cnco2)cc1)C1CC1
InChIInChI=1S/C14H14N2O2/c1-16(12-6-7-12)14(17)11-4-2-10(3-5-11)13-8-15-9-18-13/h2-5,8-9,12H,6-7H2,1H3
InChIKeyDFQDSTGMUUAVLU-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.58
Rot. Bonds3

About N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide

N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide (PubChem CID 47413926) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide
PubChem CID47413926
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC NameN-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide
SMILESCN(C(=O)c1ccc(-c2cnco2)cc1)C1CC1
InChIInChI=1S/C14H14N2O2/c1-16(12-6-7-12)14(17)11-4-2-10(3-5-11)13-8-15-9-18-13/h2-5,8-9,12H,6-7H2,1H3
InChIKeyDFQDSTGMUUAVLU-UHFFFAOYSA-N
XLogP2.58
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide?
The IUPAC name of N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide (CID 47413926) is N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide.
What is the SMILES notation for N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide?
The canonical SMILES for N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide is CN(C(=O)c1ccc(-c2cnco2)cc1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide?
The InChIKey is DFQDSTGMUUAVLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-16(12-6-7-12)14(17)11-4-2-10(3-5-11)13-8-15-9-18-13/h2-5,8-9,12H,6-7H2,1H3.
What are the key properties of N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide?
N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide has a molecular weight of 242.28 g/mol, XLogP of 2.58, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyl-4-(1,3-oxazol-5-yl)benzamide is sourced from PubChem (CID 47413926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).