(2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide

C13H14N4O4 — CID 6724762

IUPAC(2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide
SMILESO=C(Cc1ccncc1)N[C@@H](CO)C(=O)Nc1ccon1
InChIInChI=1S/C13H14N4O4/c18-8-10(13(20)16-11-3-6-21-17-11)15-12(19)7-9-1-4-14-5-2-9/h1-6,10,18H,7-8H2,(H,15,19)(H,16,17,20)/t10-/m0/s1
InChIKeyUEKILBUIHKWDRI-JTQLQIEISA-N
MW290.28 g/mol
LogP-0.27
Rot. Bonds6

About (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide

(2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide (PubChem CID 6724762) has the molecular formula C13H14N4O4 and a molecular weight of 290.28 g/mol. Its IUPAC name is (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide.

Molecular Properties

Compound Name(2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide
PubChem CID6724762
Molecular FormulaC13H14N4O4
Molecular Weight290.28 g/mol
Exact Mass290.10
IUPAC Name(2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide
SMILESO=C(Cc1ccncc1)N[C@@H](CO)C(=O)Nc1ccon1
InChIInChI=1S/C13H14N4O4/c18-8-10(13(20)16-11-3-6-21-17-11)15-12(19)7-9-1-4-14-5-2-9/h1-6,10,18H,7-8H2,(H,15,19)(H,16,17,20)/t10-/m0/s1
InChIKeyUEKILBUIHKWDRI-JTQLQIEISA-N
XLogP-0.27
TPSA117.35 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.28
LogP ≤ 5-0.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[3-(2,3,4,5,6-pentafluorophenyl)prop-2-enoylamino]propanamide
CID 6724492
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-hydroxy-2-[(2-pyridin-4-ylacetyl)amino]propanamide
CID 4165771
(2S)-N-benzyl-3-hydroxy-2-[(2-pyridin-4-ylacetyl)amino]propanamide
CID 6724767
(2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-(3-phenylprop-2-enoylamino)propanamide
CID 6724452
(2S)-3-hydroxy-N-morpholin-4-yl-2-[(2-pyridin-4-ylacetyl)amino]propanamide
CID 6724742
3-hydroxy-2-[[2-(3-hydroxy-4,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)acetyl]amino]-N-(1,2-oxazol-3-yl)propanamide
CID 3614626
N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]-2-pyridin-4-ylacetamide
CID 6724737
2,2-difluoro-N-(1,2-oxazol-3-yl)acetamide
CID 103515463
(2S)-N-(2-bicyclo[2.2.1]heptanyl)-3-hydroxy-2-[(2-pyridin-4-ylacetyl)amino]propanamide
CID 6724752
(2S)-3-hydroxy-N,N-dipropyl-2-[(2-pyridin-4-ylacetyl)amino]propanamide
CID 6724746
N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide
CID 103961002
N-(1,2-oxazol-3-yl)-2-(3-propan-2-yloxyphenyl)acetamide
CID 75399150

Frequently Asked Questions

What is the IUPAC name of (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide?
The IUPAC name of (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide (CID 6724762) is (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide.
What is the SMILES notation for (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide?
The canonical SMILES for (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide is O=C(Cc1ccncc1)N[C@@H](CO)C(=O)Nc1ccon1.
What is the InChIKey of (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide?
The InChIKey is UEKILBUIHKWDRI-JTQLQIEISA-N. The full InChI is InChI=1S/C13H14N4O4/c18-8-10(13(20)16-11-3-6-21-17-11)15-12(19)7-9-1-4-14-5-2-9/h1-6,10,18H,7-8H2,(H,15,19)(H,16,17,20)/t10-/m0/s1.
What are the key properties of (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide?
(2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide has a molecular weight of 290.28 g/mol, XLogP of -0.27, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-3-hydroxy-N-(1,2-oxazol-3-yl)-2-[(2-pyridin-4-ylacetyl)amino]propanamide is sourced from PubChem (CID 6724762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).