N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide

C19H24N2O3 — CID 95132894

IUPACN-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide
SMILESC[C@@H](CCc1ccco1)NC(=O)c1ccccc1N1CCOCC1
InChIInChI=1S/C19H24N2O3/c1-15(8-9-16-5-4-12-24-16)20-19(22)17-6-2-3-7-18(17)21-10-13-23-14-11-21/h2-7,12,15H,8-11,13-14H2,1H3,(H,20,22)/t15-/m0/s1
InChIKeyAGAHSXVWMFVVNZ-HNNXBMFYSA-N
MW328.41 g/mol
LogP2.87
Rot. Bonds6

About N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide

N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide (PubChem CID 95132894) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide.

Molecular Properties

Compound NameN-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide
PubChem CID95132894
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide
SMILESC[C@@H](CCc1ccco1)NC(=O)c1ccccc1N1CCOCC1
InChIInChI=1S/C19H24N2O3/c1-15(8-9-16-5-4-12-24-16)20-19(22)17-6-2-3-7-18(17)21-10-13-23-14-11-21/h2-7,12,15H,8-11,13-14H2,1H3,(H,20,22)/t15-/m0/s1
InChIKeyAGAHSXVWMFVVNZ-HNNXBMFYSA-N
XLogP2.87
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(furan-2-yl)butan-2-yl]-4-morpholin-4-yl-3-nitrobenzamide
CID 18110242
N-[4-(furan-2-yl)butan-2-yl]-2-methoxybenzamide
CID 18162458
2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 62661107
N-[2-(methylamino)propyl]-2-morpholin-4-ylbenzamide
CID 120827445
2-morpholin-4-ylbenzohydrazide
CID 7148386
N-[2-(methylamino)propyl]-2-morpholin-4-ylbenzamide;dihydrochloride
CID 120827444
N-[(2S)-1-hydroxy-4-methylsulfanylbutan-2-yl]-2-morpholin-4-ylbenzamide
CID 131942666
N-(1-imidazol-1-yl-3-methylbutan-2-yl)-2-morpholin-4-ylbenzamide
CID 50956729
4-(furan-2-yl)-N-(2-morpholin-4-ylethyl)butan-2-amine
CID 43393721
4-fluoro-N-[4-(furan-2-yl)butan-2-yl]-2-methylbenzamide
CID 115745188
2-fluoro-N-[4-(furan-2-yl)butan-2-yl]-4-methylbenzamide
CID 79769993
6-(furan-2-yl)-N-[4-(furan-2-yl)butan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 56821017

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide?
The IUPAC name of N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide (CID 95132894) is N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide.
What is the SMILES notation for N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide?
The canonical SMILES for N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide is C[C@@H](CCc1ccco1)NC(=O)c1ccccc1N1CCOCC1.
What is the InChIKey of N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide?
The InChIKey is AGAHSXVWMFVVNZ-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-15(8-9-16-5-4-12-24-16)20-19(22)17-6-2-3-7-18(17)21-10-13-23-14-11-21/h2-7,12,15H,8-11,13-14H2,1H3,(H,20,22)/t15-/m0/s1.
What are the key properties of N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide?
N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide has a molecular weight of 328.41 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide is sourced from PubChem (CID 95132894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).