2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide

C17H20N2O3 — CID 110016334

IUPAC2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide
SMILESCc1coc(-c2cc(NC(=O)C3CCCC3O)ccc2C)n1
InChIInChI=1S/C17H20N2O3/c1-10-6-7-12(8-14(10)17-18-11(2)9-22-17)19-16(21)13-4-3-5-15(13)20/h6-9,13,15,20H,3-5H2,1-2H3,(H,19,21)
InChIKeyYQKQJPUPIDQBRC-UHFFFAOYSA-N
MW300.36 g/mol
LogP3.06
Rot. Bonds3

About 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide

2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide (PubChem CID 110016334) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide
PubChem CID110016334
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide
SMILESCc1coc(-c2cc(NC(=O)C3CCCC3O)ccc2C)n1
InChIInChI=1S/C17H20N2O3/c1-10-6-7-12(8-14(10)17-18-11(2)9-22-17)19-16(21)13-4-3-5-15(13)20/h6-9,13,15,20H,3-5H2,1-2H3,(H,19,21)
InChIKeyYQKQJPUPIDQBRC-UHFFFAOYSA-N
XLogP3.06
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide (CID 110016334) is 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide is Cc1coc(-c2cc(NC(=O)C3CCCC3O)ccc2C)n1.
What is the InChIKey of 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide?
The InChIKey is YQKQJPUPIDQBRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-10-6-7-12(8-14(10)17-18-11(2)9-22-17)19-16(21)13-4-3-5-15(13)20/h6-9,13,15,20H,3-5H2,1-2H3,(H,19,21).
What are the key properties of 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide?
2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[4-methyl-3-(4-methyl-1,3-oxazol-2-yl)phenyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 110016334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).