(2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide

C19H23N3O3 — CID 51886390

IUPAC(2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide
SMILESCC[C@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cn1
InChIInChI=1S/C19H23N3O3/c1-2-17(25-16-6-4-3-5-7-16)19(23)21-18-9-8-15(14-20-18)22-10-12-24-13-11-22/h3-9,14,17H,2,10-13H2,1H3,(H,20,21,23)/t17-/m0/s1
InChIKeyMPHBTENBRMWJHH-KRWDZBQOSA-N
MW341.41 g/mol
LogP2.71
Rot. Bonds6

About (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide

(2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide (PubChem CID 51886390) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide.

Molecular Properties

Compound Name(2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide
PubChem CID51886390
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name(2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide
SMILESCC[C@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cn1
InChIInChI=1S/C19H23N3O3/c1-2-17(25-16-6-4-3-5-7-16)19(23)21-18-9-8-15(14-20-18)22-10-12-24-13-11-22/h3-9,14,17H,2,10-13H2,1H3,(H,20,21,23)/t17-/m0/s1
InChIKeyMPHBTENBRMWJHH-KRWDZBQOSA-N
XLogP2.71
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide
CID 43049101
N-(5-morpholin-4-yl-2-pyridinyl)-3-phenylbutanamide
CID 134053190
(2R)-2-phenoxy-N-(4-pyrrolidin-1-ylphenyl)butanamide
CID 41491672
(2R)-2-phenoxy-N-(4-piperidin-1-ylphenyl)butanamide
CID 7409300
[(2S)-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl] (2S)-2-phenoxybutanoate
CID 7149760
2-ethyl-N-[5-[4-(4-methoxyphenyl)piperazin-1-yl]-2-pyridinyl]butanamide
CID 113031151
3-(2-fluorophenyl)-N-(5-morpholin-4-yl-2-pyridinyl)propanamide
CID 38140626
(2R)-N-[4-(morpholine-4-carbonyl)phenyl]-2-phenoxybutanamide
CID 42579548
N-[2-[(5-morpholin-4-yl-2-pyridinyl)amino]-2-oxoethyl]benzamide
CID 38141318
2-(difluoromethoxy)-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 25345280
2-(2,3-dihydroindol-1-yl)-N-(5-morpholin-4-yl-2-pyridinyl)propanamide
CID 126768965
(2R)-2-methyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)butanamide
CID 94809238

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide?
The IUPAC name of (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide (CID 51886390) is (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide.
What is the SMILES notation for (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide?
The canonical SMILES for (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide is CC[C@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cn1.
What is the InChIKey of (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide?
The InChIKey is MPHBTENBRMWJHH-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-2-17(25-16-6-4-3-5-7-16)19(23)21-18-9-8-15(14-20-18)22-10-12-24-13-11-22/h3-9,14,17H,2,10-13H2,1H3,(H,20,21,23)/t17-/m0/s1.
What are the key properties of (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide?
(2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide has a molecular weight of 341.41 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(5-morpholin-4-yl-2-pyridinyl)-2-phenoxybutanamide is sourced from PubChem (CID 51886390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).