N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide

C15H23N3O2 — CID 95771247

IUPACN-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide
SMILESC[C@@H](CCN1CCOCC1)NC(=O)Cc1cccnc1
InChIInChI=1S/C15H23N3O2/c1-13(4-6-18-7-9-20-10-8-18)17-15(19)11-14-3-2-5-16-12-14/h2-3,5,12-13H,4,6-11H2,1H3,(H,17,19)/t13-/m0/s1
InChIKeyCZDPSXVPZARYOE-ZDUSSCGKSA-N
MW277.37 g/mol
LogP0.85
Rot. Bonds6

About N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide

N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide (PubChem CID 95771247) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide
PubChem CID95771247
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide
SMILESC[C@@H](CCN1CCOCC1)NC(=O)Cc1cccnc1
InChIInChI=1S/C15H23N3O2/c1-13(4-6-18-7-9-20-10-8-18)17-15(19)11-14-3-2-5-16-12-14/h2-3,5,12-13H,4,6-11H2,1H3,(H,17,19)/t13-/m0/s1
InChIKeyCZDPSXVPZARYOE-ZDUSSCGKSA-N
XLogP0.85
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-hydroxybutan-2-yl)-2-pyridin-3-ylacetamide
CID 115283484
N-(1-hydroxypropan-2-yl)-2-pyridin-3-ylacetamide
CID 62691061
2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide
CID 108994762
1-(3-morpholin-4-ylpropyl)-3-(pyridin-3-ylmethyl)urea
CID 127566290
1-morpholin-4-yl-3-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one
CID 84592394
16-(pyridin-3-ylmethyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 11523230
methyl 2-[(2-pyridin-3-ylacetyl)amino]propanoate
CID 62690739
N-(1-pyridin-3-ylethyl)morpholine-4-carboxamide
CID 115576612
N-(2-morpholin-4-ylethyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 47039155
3-hydroxy-2-[(2-pyridin-3-ylacetyl)amino]butanoic acid
CID 55100610
2-(2-hydroxyphenyl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 78990786
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-(pyridin-3-ylmethylsulfanyl)acetamide
CID 47029720

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide (CID 95771247) is N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide is C[C@@H](CCN1CCOCC1)NC(=O)Cc1cccnc1.
What is the InChIKey of N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide?
The InChIKey is CZDPSXVPZARYOE-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-13(4-6-18-7-9-20-10-8-18)17-15(19)11-14-3-2-5-16-12-14/h2-3,5,12-13H,4,6-11H2,1H3,(H,17,19)/t13-/m0/s1.
What are the key properties of N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide?
N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide has a molecular weight of 277.37 g/mol, XLogP of 0.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-4-morpholin-4-ylbutan-2-yl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 95771247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).