(6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide

C16H21N3O3 — CID 95135103

IUPAC(6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide
SMILESCc1nc2ccc(NC(=O)N3C[C@@H](C)OC(C)(C)C3)cc2o1
InChIInChI=1S/C16H21N3O3/c1-10-8-19(9-16(3,4)22-10)15(20)18-12-5-6-13-14(7-12)21-11(2)17-13/h5-7,10H,8-9H2,1-4H3,(H,18,20)/t10-/m1/s1
InChIKeyZGWMXRVSZUKRNA-SNVBAGLBSA-N
MW303.36 g/mol
LogP3.17
Rot. Bonds1

About (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide

(6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide (PubChem CID 95135103) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide
PubChem CID95135103
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name(6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide
SMILESCc1nc2ccc(NC(=O)N3C[C@@H](C)OC(C)(C)C3)cc2o1
InChIInChI=1S/C16H21N3O3/c1-10-8-19(9-16(3,4)22-10)15(20)18-12-5-6-13-14(7-12)21-11(2)17-13/h5-7,10H,8-9H2,1-4H3,(H,18,20)/t10-/m1/s1
InChIKeyZGWMXRVSZUKRNA-SNVBAGLBSA-N
XLogP3.17
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetylphenyl)-2,2,6-trimethylmorpholine-4-carboxamide
CID 48630543
N-(1-acetyl-2,3-dihydroindol-5-yl)-2,2,6-trimethylmorpholine-4-carboxamide
CID 48639256
2,2,6-trimethyl-N-[3-(pyrrolidine-1-carbonyl)phenyl]morpholine-4-carboxamide
CID 48639893
N-(5-acetamido-2-chlorophenyl)-2,2,6-trimethylmorpholine-4-carboxamide
CID 48641749
(6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide
CID 129403242
N-(2-methyl-1,3-benzoxazol-6-yl)carbamoyl bromide
CID 115193310
N-(4-cyclopentyloxyphenyl)-2,2,6-trimethylmorpholine-4-carboxamide
CID 48640265
N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2,2,6-trimethylmorpholine-4-carboxamide
CID 71884973
2-[(2-methyl-1,3-benzoxazol-6-yl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120974727
2,2-dimethyl-3-[(2-methyl-1,3-benzoxazol-6-yl)amino]-3-oxopropanoic acid
CID 115163948
2,2,6-trimethyl-N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-4-carboxamide
CID 48640230
3-methyl-N-(2-methyl-1,3-benzoxazol-6-yl)-1-oxo-4H-isochromene-3-carboxamide
CID 86921779

Frequently Asked Questions

What is the IUPAC name of (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide?
The IUPAC name of (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide (CID 95135103) is (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide.
What is the SMILES notation for (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide?
The canonical SMILES for (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide is Cc1nc2ccc(NC(=O)N3C[C@@H](C)OC(C)(C)C3)cc2o1.
What is the InChIKey of (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide?
The InChIKey is ZGWMXRVSZUKRNA-SNVBAGLBSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-10-8-19(9-16(3,4)22-10)15(20)18-12-5-6-13-14(7-12)21-11(2)17-13/h5-7,10H,8-9H2,1-4H3,(H,18,20)/t10-/m1/s1.
What are the key properties of (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide?
(6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide has a molecular weight of 303.36 g/mol, XLogP of 3.17, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide is sourced from PubChem (CID 95135103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).