N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide

C15H23N3O4 — CID 110128087

IUPACN-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)N[C@@H]2CCC[C@@H](N3CCOCC3)[C@@H]2O)no1
InChIInChI=1S/C15H23N3O4/c1-10-9-12(17-22-10)15(20)16-11-3-2-4-13(14(11)19)18-5-7-21-8-6-18/h9,11,13-14,19H,2-8H2,1H3,(H,16,20)/t11-,13-,14-/m1/s1
InChIKeyFVYZSDGTAZMKGH-MRVWCRGKSA-N
MW309.37 g/mol
LogP0.33
Rot. Bonds3

About N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide

N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 110128087) has the molecular formula C15H23N3O4 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID110128087
Molecular FormulaC15H23N3O4
Molecular Weight309.37 g/mol
Exact Mass309.17
IUPAC NameN-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)N[C@@H]2CCC[C@@H](N3CCOCC3)[C@@H]2O)no1
InChIInChI=1S/C15H23N3O4/c1-10-9-12(17-22-10)15(20)16-11-3-2-4-13(14(11)19)18-5-7-21-8-6-18/h9,11,13-14,19H,2-8H2,1H3,(H,16,20)/t11-,13-,14-/m1/s1
InChIKeyFVYZSDGTAZMKGH-MRVWCRGKSA-N
XLogP0.33
TPSA87.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide (CID 110128087) is N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)N[C@@H]2CCC[C@@H](N3CCOCC3)[C@@H]2O)no1.
What is the InChIKey of N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is FVYZSDGTAZMKGH-MRVWCRGKSA-N. The full InChI is InChI=1S/C15H23N3O4/c1-10-9-12(17-22-10)15(20)16-11-3-2-4-13(14(11)19)18-5-7-21-8-6-18/h9,11,13-14,19H,2-8H2,1H3,(H,16,20)/t11-,13-,14-/m1/s1.
What are the key properties of N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide?
N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 0.33, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R,3R)-2-hydroxy-3-morpholin-4-ylcyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 110128087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).