(6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide

C18H28N2O3 — CID 129403242

IUPAC(6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide
SMILESCC(C)OCc1ccc(NC(=O)N2C[C@@H](C)OC(C)(C)C2)cc1
InChIInChI=1S/C18H28N2O3/c1-13(2)22-11-15-6-8-16(9-7-15)19-17(21)20-10-14(3)23-18(4,5)12-20/h6-9,13-14H,10-12H2,1-5H3,(H,19,21)/t14-/m1/s1
InChIKeyWPXSEZZQTWXRMX-CQSZACIVSA-N
MW320.43 g/mol
LogP3.64
Rot. Bonds4

About (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide

(6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide (PubChem CID 129403242) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide
PubChem CID129403242
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC Name(6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide
SMILESCC(C)OCc1ccc(NC(=O)N2C[C@@H](C)OC(C)(C)C2)cc1
InChIInChI=1S/C18H28N2O3/c1-13(2)22-11-15-6-8-16(9-7-15)19-17(21)20-10-14(3)23-18(4,5)12-20/h6-9,13-14H,10-12H2,1-5H3,(H,19,21)/t14-/m1/s1
InChIKeyWPXSEZZQTWXRMX-CQSZACIVSA-N
XLogP3.64
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-2,2,6-trimethylmorpholine-4-carboxamide
CID 48630543
N-(4-cyclopentyloxyphenyl)-2,2,6-trimethylmorpholine-4-carboxamide
CID 48640265
(6R)-2,2,6-trimethyl-N-(2-methyl-1,3-benzoxazol-6-yl)morpholine-4-carboxamide
CID 95135103
N-(5-acetamido-2-chlorophenyl)-2,2,6-trimethylmorpholine-4-carboxamide
CID 48641749
methyl 1-methyl-4-[[(6S)-2,2,6-trimethylmorpholine-4-carbonyl]amino]pyrrole-2-carboxylate
CID 164635761
6-(hydroxymethyl)-N-(4-methoxyphenyl)-2,2-dimethylmorpholine-4-carboxamide
CID 114779052
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-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2,2,6-trimethylmorpholine-4-carboxamide
CID 71884973
(2R,6R)-2,6-dimethyl-N-(4-propan-2-yloxyphenyl)morpholine-4-carboxamide
CID 94187636
(2R,6S)-N-[4-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]phenyl]-2,6-dimethylmorpholine-4-carboxamide
CID 51983955
2,2,6-trimethyl-N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-4-carboxamide
CID 48640230

Frequently Asked Questions

What is the IUPAC name of (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide?
The IUPAC name of (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide (CID 129403242) is (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide.
What is the SMILES notation for (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide?
The canonical SMILES for (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide is CC(C)OCc1ccc(NC(=O)N2C[C@@H](C)OC(C)(C)C2)cc1.
What is the InChIKey of (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide?
The InChIKey is WPXSEZZQTWXRMX-CQSZACIVSA-N. The full InChI is InChI=1S/C18H28N2O3/c1-13(2)22-11-15-6-8-16(9-7-15)19-17(21)20-10-14(3)23-18(4,5)12-20/h6-9,13-14H,10-12H2,1-5H3,(H,19,21)/t14-/m1/s1.
What are the key properties of (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide?
(6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide has a molecular weight of 320.43 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-2,2,6-trimethyl-N-[4-(propan-2-yloxymethyl)phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 129403242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).