N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide

C20H20N2O2S — CID 37483995

IUPACN-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)N(Cc1cccs1)C1CC1
InChIInChI=1S/C20H20N2O2S/c23-20(22(16-8-9-16)14-17-7-4-12-25-17)11-10-19-21-13-18(24-19)15-5-2-1-3-6-15/h1-7,12-13,16H,8-11,14H2
InChIKeyWNGWQZPOOIPGBZ-UHFFFAOYSA-N
MW352.46 g/mol
LogP4.53
Rot. Bonds7

About N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide

N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide (PubChem CID 37483995) has the molecular formula C20H20N2O2S and a molecular weight of 352.46 g/mol. Its IUPAC name is N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide
PubChem CID37483995
Molecular FormulaC20H20N2O2S
Molecular Weight352.46 g/mol
Exact Mass352.12
IUPAC NameN-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)N(Cc1cccs1)C1CC1
InChIInChI=1S/C20H20N2O2S/c23-20(22(16-8-9-16)14-17-7-4-12-25-17)11-10-19-21-13-18(24-19)15-5-2-1-3-6-15/h1-7,12-13,16H,8-11,14H2
InChIKeyWNGWQZPOOIPGBZ-UHFFFAOYSA-N
XLogP4.53
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide?
The IUPAC name of N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide (CID 37483995) is N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide is O=C(CCc1ncc(-c2ccccc2)o1)N(Cc1cccs1)C1CC1.
What is the InChIKey of N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide?
The InChIKey is WNGWQZPOOIPGBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2S/c23-20(22(16-8-9-16)14-17-7-4-12-25-17)11-10-19-21-13-18(24-19)15-5-2-1-3-6-15/h1-7,12-13,16H,8-11,14H2.
What are the key properties of N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide?
N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide has a molecular weight of 352.46 g/mol, XLogP of 4.53, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-(thiophen-2-ylmethyl)propanamide is sourced from PubChem (CID 37483995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).