N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide

C18H21FN4O3 — CID 56524799

IUPACN-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide
SMILESCc1cc(C(=O)N2CCN(CCC(=O)Nc3ccccc3F)CC2)on1
InChIInChI=1S/C18H21FN4O3/c1-13-12-16(26-21-13)18(25)23-10-8-22(9-11-23)7-6-17(24)20-15-5-3-2-4-14(15)19/h2-5,12H,6-11H2,1H3,(H,20,24)
InChIKeyLXZMNMMWKQGAII-UHFFFAOYSA-N
MW360.39 g/mol
LogP1.91
Rot. Bonds5

About N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide

N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide (PubChem CID 56524799) has the molecular formula C18H21FN4O3 and a molecular weight of 360.39 g/mol. Its IUPAC name is N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide
PubChem CID56524799
Molecular FormulaC18H21FN4O3
Molecular Weight360.39 g/mol
Exact Mass360.16
IUPAC NameN-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide
SMILESCc1cc(C(=O)N2CCN(CCC(=O)Nc3ccccc3F)CC2)on1
InChIInChI=1S/C18H21FN4O3/c1-13-12-16(26-21-13)18(25)23-10-8-22(9-11-23)7-6-17(24)20-15-5-3-2-4-14(15)19/h2-5,12H,6-11H2,1H3,(H,20,24)
InChIKeyLXZMNMMWKQGAII-UHFFFAOYSA-N
XLogP1.91
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-fluorophenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide
CID 78882336
2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)acetamide
CID 78900724
N-(2-ethylphenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetamide
CID 27852116
N-(2-fluorophenyl)-3-morpholin-4-ylpropanamide
CID 575001
3-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide
CID 31932591
3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(2-fluorophenyl)propanamide
CID 24589190
methyl 4-(3-methyl-1,2-oxazole-5-carbonyl)piperazine-1-carboxylate
CID 78904854
3-[4-(cyclopentanecarbonyl)piperazin-1-yl]-N-(2-fluorophenyl)propanamide
CID 36881302
N-(2-fluorophenyl)-3-thiomorpholin-4-ylpropanamide
CID 91843372
3-[4-[2-(difluoromethoxy)benzoyl]piperazin-1-yl]-N-(2-fluorophenyl)propanamide
CID 37451220
(3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone
CID 20868333
N-(2-fluorophenyl)-3-piperidin-1-ylpropanamide;oxalic acid
CID 171154607

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide?
The IUPAC name of N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide (CID 56524799) is N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide is Cc1cc(C(=O)N2CCN(CCC(=O)Nc3ccccc3F)CC2)on1.
What is the InChIKey of N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide?
The InChIKey is LXZMNMMWKQGAII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN4O3/c1-13-12-16(26-21-13)18(25)23-10-8-22(9-11-23)7-6-17(24)20-15-5-3-2-4-14(15)19/h2-5,12H,6-11H2,1H3,(H,20,24).
What are the key properties of N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide?
N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide has a molecular weight of 360.39 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-3-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 56524799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).