N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide

C26H29N3O4 — CID 52582079

IUPACN-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
SMILESO=C(NC[C@@H]([C@H]1CCOC1)N1CCOCC1)c1ccccc1-c1ncc(-c2ccccc2)o1
InChIInChI=1S/C26H29N3O4/c30-25(27-16-23(20-10-13-32-18-20)29-11-14-31-15-12-29)21-8-4-5-9-22(21)26-28-17-24(33-26)19-6-2-1-3-7-19/h1-9,17,20,23H,10-16,18H2,(H,27,30)/t20-,23-/m0/s1
InChIKeyBPSUMDRZZCFHSX-REWPJTCUSA-N
MW447.54 g/mol
LogP3.48
Rot. Bonds7

About N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide

N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide (PubChem CID 52582079) has the molecular formula C26H29N3O4 and a molecular weight of 447.54 g/mol. Its IUPAC name is N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide.

Molecular Properties

Compound NameN-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
PubChem CID52582079
Molecular FormulaC26H29N3O4
Molecular Weight447.54 g/mol
Exact Mass447.22
IUPAC NameN-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
SMILESO=C(NC[C@@H]([C@H]1CCOC1)N1CCOCC1)c1ccccc1-c1ncc(-c2ccccc2)o1
InChIInChI=1S/C26H29N3O4/c30-25(27-16-23(20-10-13-32-18-20)29-11-14-31-15-12-29)21-8-4-5-9-22(21)26-28-17-24(33-26)19-6-2-1-3-7-19/h1-9,17,20,23H,10-16,18H2,(H,27,30)/t20-,23-/m0/s1
InChIKeyBPSUMDRZZCFHSX-REWPJTCUSA-N
XLogP3.48
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.54
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Launch Full Analysis

Related Compounds

2-methoxy-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]pyridine-3-carboxamide
CID 94024269
2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
CID 55642293
1,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
CID 94021725
1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
CID 94021723
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide
CID 94083483
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94083431
N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 133150056
3-(2-chlorophenyl)-5-methyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1,2-oxazole-4-carboxamide
CID 78858830
(2S)-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-2-phenylbutanamide
CID 94150246
2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide
CID 94083341
N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 94021743
1-[cyclopropyl(phenyl)methyl]-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55590697

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The IUPAC name of N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide (CID 52582079) is N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide.
What is the SMILES notation for N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The canonical SMILES for N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide is O=C(NC[C@@H]([C@H]1CCOC1)N1CCOCC1)c1ccccc1-c1ncc(-c2ccccc2)o1.
What is the InChIKey of N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The InChIKey is BPSUMDRZZCFHSX-REWPJTCUSA-N. The full InChI is InChI=1S/C26H29N3O4/c30-25(27-16-23(20-10-13-32-18-20)29-11-14-31-15-12-29)21-8-4-5-9-22(21)26-28-17-24(33-26)19-6-2-1-3-7-19/h1-9,17,20,23H,10-16,18H2,(H,27,30)/t20-,23-/m0/s1.
What are the key properties of N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide has a molecular weight of 447.54 g/mol, XLogP of 3.48, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide is sourced from PubChem (CID 52582079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).