5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide

C20H24N2O2 — CID 124726781

IUPAC5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide
SMILESCc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2cc(C3CC3)on2)cc1
InChIInChI=1S/C20H24N2O2/c1-13-6-8-14(9-7-13)16-4-3-5-18(16)22(2)20(23)17-12-19(24-21-17)15-10-11-15/h6-9,12,15-16,18H,3-5,10-11H2,1-2H3/t16-,18-/m1/s1
InChIKeyCJLSHOJEDPDYRJ-SJLPKXTDSA-N
MW324.42 g/mol
LogP4.27
Rot. Bonds4

About 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide (PubChem CID 124726781) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide
PubChem CID124726781
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide
SMILESCc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2cc(C3CC3)on2)cc1
InChIInChI=1S/C20H24N2O2/c1-13-6-8-14(9-7-13)16-4-3-5-18(16)22(2)20(23)17-12-19(24-21-17)15-10-11-15/h6-9,12,15-16,18H,3-5,10-11H2,1-2H3/t16-,18-/m1/s1
InChIKeyCJLSHOJEDPDYRJ-SJLPKXTDSA-N
XLogP4.27
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide (CID 124726781) is 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide is Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2cc(C3CC3)on2)cc1.
What is the InChIKey of 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide?
The InChIKey is CJLSHOJEDPDYRJ-SJLPKXTDSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-13-6-8-14(9-7-13)16-4-3-5-18(16)22(2)20(23)17-12-19(24-21-17)15-10-11-15/h6-9,12,15-16,18H,3-5,10-11H2,1-2H3/t16-,18-/m1/s1.
What are the key properties of 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide has a molecular weight of 324.42 g/mol, XLogP of 4.27, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-methyl-N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 124726781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).