N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide

C22H29N3O4 — CID 11463707

IUPACN-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide
SMILESCCCC(NC(=O)C(O)c1ccccc1)C(=O)Nc1cc(C2CCCCC2)on1
InChIInChI=1S/C22H29N3O4/c1-2-9-17(23-22(28)20(26)16-12-7-4-8-13-16)21(27)24-19-14-18(29-25-19)15-10-5-3-6-11-15/h4,7-8,12-15,17,20,26H,2-3,5-6,9-11H2,1H3,(H,23,28)(H,24,25,27)
InChIKeyLAMYWZDUELEOFQ-UHFFFAOYSA-N
MW399.49 g/mol
LogP3.68
Rot. Bonds8

About N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide

N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide (PubChem CID 11463707) has the molecular formula C22H29N3O4 and a molecular weight of 399.49 g/mol. Its IUPAC name is N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide.

Molecular Properties

Compound NameN-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide
PubChem CID11463707
Molecular FormulaC22H29N3O4
Molecular Weight399.49 g/mol
Exact Mass399.22
IUPAC NameN-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide
SMILESCCCC(NC(=O)C(O)c1ccccc1)C(=O)Nc1cc(C2CCCCC2)on1
InChIInChI=1S/C22H29N3O4/c1-2-9-17(23-22(28)20(26)16-12-7-4-8-13-16)21(27)24-19-14-18(29-25-19)15-10-5-3-6-11-15/h4,7-8,12-15,17,20,26H,2-3,5-6,9-11H2,1H3,(H,23,28)(H,24,25,27)
InChIKeyLAMYWZDUELEOFQ-UHFFFAOYSA-N
XLogP3.68
TPSA104.46 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.49
LogP ≤ 53.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide?
The IUPAC name of N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide (CID 11463707) is N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide.
What is the SMILES notation for N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide?
The canonical SMILES for N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide is CCCC(NC(=O)C(O)c1ccccc1)C(=O)Nc1cc(C2CCCCC2)on1.
What is the InChIKey of N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide?
The InChIKey is LAMYWZDUELEOFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O4/c1-2-9-17(23-22(28)20(26)16-12-7-4-8-13-16)21(27)24-19-14-18(29-25-19)15-10-5-3-6-11-15/h4,7-8,12-15,17,20,26H,2-3,5-6,9-11H2,1H3,(H,23,28)(H,24,25,27).
What are the key properties of N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide?
N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide has a molecular weight of 399.49 g/mol, XLogP of 3.68, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclohexyl-1,2-oxazol-3-yl)-2-[(2-hydroxy-2-phenylacetyl)amino]pentanamide is sourced from PubChem (CID 11463707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).