(2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide

C17H24N2O3 — CID 126826032

IUPAC(2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
SMILESCCN(C(=O)[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C17H24N2O3/c1-2-19(17(20)16-4-3-11-22-16)15-7-5-14(6-8-15)18-9-12-21-13-10-18/h5-8,16H,2-4,9-13H2,1H3/t16-/m1/s1
InChIKeyLHRLZQMCYSCPKU-MRXNPFEDSA-N
MW304.39 g/mol
LogP2.06
Rot. Bonds4

About (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide

(2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide (PubChem CID 126826032) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
PubChem CID126826032
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name(2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
SMILESCCN(C(=O)[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C17H24N2O3/c1-2-19(17(20)16-4-3-11-22-16)15-7-5-14(6-8-15)18-9-12-21-13-10-18/h5-8,16H,2-4,9-13H2,1H3/t16-/m1/s1
InChIKeyLHRLZQMCYSCPKU-MRXNPFEDSA-N
XLogP2.06
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-methyl-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]oxolane-2-carboxamide
CID 9409375
(2R)-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
CID 2476290
N-[(4-morpholin-4-ylphenyl)methyl]oxolane-2-carboxamide
CID 110405121
N-[2-(4-morpholin-4-ylphenyl)-2-oxoethyl]oxolane-2-carboxamide
CID 84580144
oxolan-2-yl-[4-(4-pyrrolidin-1-ylphenyl)piperazin-1-yl]methanone
CID 113078894
3-(N-[(2R)-oxolane-2-carbonyl]anilino)propanoic acid
CID 93332713
[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone
CID 101130657
N-cyclopentyl-N-methyl-4-morpholin-4-ylbenzamide
CID 43910092
[4-(4-hydroxyphenyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 47098482
4-(N-[(2R)-oxolane-2-carbonyl]anilino)butanoic acid
CID 104855556
N-ethyl-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]cyclopentanecarboxamide
CID 8960463
N-[4-(azepan-1-yl)phenyl]oxolane-2-carboxamide
CID 51197534

Frequently Asked Questions

What is the IUPAC name of (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide?
The IUPAC name of (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide (CID 126826032) is (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide is CCN(C(=O)[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide?
The InChIKey is LHRLZQMCYSCPKU-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-2-19(17(20)16-4-3-11-22-16)15-7-5-14(6-8-15)18-9-12-21-13-10-18/h5-8,16H,2-4,9-13H2,1H3/t16-/m1/s1.
What are the key properties of (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide?
(2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-ethyl-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide is sourced from PubChem (CID 126826032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).