N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide

C16H25N3O2 — CID 110446322

IUPACN-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide
SMILESCC(C(=O)Nc1ccnc(C(C)(C)C)c1)N1CCOCC1
InChIInChI=1S/C16H25N3O2/c1-12(19-7-9-21-10-8-19)15(20)18-13-5-6-17-14(11-13)16(2,3)4/h5-6,11-12H,7-10H2,1-4H3,(H,17,18,20)
InChIKeyLLBOJGBKFWYBOX-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.04
Rot. Bonds3

About N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide

N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide (PubChem CID 110446322) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide
PubChem CID110446322
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide
SMILESCC(C(=O)Nc1ccnc(C(C)(C)C)c1)N1CCOCC1
InChIInChI=1S/C16H25N3O2/c1-12(19-7-9-21-10-8-19)15(20)18-13-5-6-17-14(11-13)16(2,3)4/h5-6,11-12H,7-10H2,1-4H3,(H,17,18,20)
InChIKeyLLBOJGBKFWYBOX-UHFFFAOYSA-N
XLogP2.04
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylacetamide
CID 110444182
(2R)-N-(3-acetylphenyl)-2-morpholin-4-ylpropanamide
CID 8903956
N-(3,4-difluorophenyl)-2-morpholin-4-ylpropanamide
CID 46630811
N-(4-methyl-2-oxochromen-7-yl)-2-morpholin-4-ylpropanamide
CID 171915554
2-(4-morpholin-4-ylpiperidin-1-yl)-N-pyridin-2-ylpropanamide
CID 91830061
N-(2-tert-butyl-4-pyridinyl)pyridine-4-carboxamide
CID 110444823
N-(2,6-dibromo-4-methylphenyl)-2-morpholin-4-ylpropanamide
CID 5094614
N-(2,3-dichlorophenyl)-2-morpholin-4-ylpropanamide
CID 51167813
(2R)-2-morpholin-4-yl-N-(2-phenylphenyl)propanamide
CID 1429478
2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 42889908
N-[3-(1,3-oxazol-2-yl)phenyl]-2-thiomorpholin-4-ylpropanamide
CID 75388529
(2R)-N-(2-benzoyl-4-methylphenyl)-2-morpholin-4-ylpropanamide
CID 6551381

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide?
The IUPAC name of N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide (CID 110446322) is N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide.
What is the SMILES notation for N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide?
The canonical SMILES for N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide is CC(C(=O)Nc1ccnc(C(C)(C)C)c1)N1CCOCC1.
What is the InChIKey of N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide?
The InChIKey is LLBOJGBKFWYBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12(19-7-9-21-10-8-19)15(20)18-13-5-6-17-14(11-13)16(2,3)4/h5-6,11-12H,7-10H2,1-4H3,(H,17,18,20).
What are the key properties of N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide?
N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide has a molecular weight of 291.39 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butyl-4-pyridinyl)-2-morpholin-4-ylpropanamide is sourced from PubChem (CID 110446322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).