4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide

C18H24N4O2 — CID 113112335

IUPAC4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide
SMILESCc1cc(N2CCN(C(=O)Nc3ccccc3C(C)C)CC2)no1
InChIInChI=1S/C18H24N4O2/c1-13(2)15-6-4-5-7-16(15)19-18(23)22-10-8-21(9-11-22)17-12-14(3)24-20-17/h4-7,12-13H,8-11H2,1-3H3,(H,19,23)
InChIKeyBGBCZDLBAVSMRB-UHFFFAOYSA-N
MW328.42 g/mol
LogP3.46
Rot. Bonds3

About 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide

4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide (PubChem CID 113112335) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide
PubChem CID113112335
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide
SMILESCc1cc(N2CCN(C(=O)Nc3ccccc3C(C)C)CC2)no1
InChIInChI=1S/C18H24N4O2/c1-13(2)15-6-4-5-7-16(15)19-18(23)22-10-8-21(9-11-22)17-12-14(3)24-20-17/h4-7,12-13H,8-11H2,1-3H3,(H,19,23)
InChIKeyBGBCZDLBAVSMRB-UHFFFAOYSA-N
XLogP3.46
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methylphenyl)-4-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 113113238
N-(4-bromo-2-methylphenyl)-4-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 113114627
N-(3-acetamidophenyl)-4-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 113114278
N-(5-methyl-1,2-oxazol-3-yl)-4-(2-methyl-6-propan-2-ylphenyl)piperazine-1-carboxamide
CID 113112562
N-(2-propan-2-ylphenyl)morpholine-4-carboxamide
CID 3684146
4-(5-methyl-1,2-oxazol-3-yl)-N-(2-methylpropyl)piperazine-1-carboxamide
CID 113104147
N-butan-2-yl-4-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 113104409
4-(2,6-difluorophenyl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide
CID 113112333
4-(5-methyl-1,2-oxazol-3-yl)-N-(4-pyrrolidin-1-ylphenyl)piperazine-1-carboxamide
CID 113114488
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 113114690
4-methyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide
CID 108987988
N-(3-chloro-4-fluorophenyl)-4-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 113113365

Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide?
The IUPAC name of 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide (CID 113112335) is 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide is Cc1cc(N2CCN(C(=O)Nc3ccccc3C(C)C)CC2)no1.
What is the InChIKey of 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide?
The InChIKey is BGBCZDLBAVSMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-13(2)15-6-4-5-7-16(15)19-18(23)22-10-8-21(9-11-22)17-12-14(3)24-20-17/h4-7,12-13H,8-11H2,1-3H3,(H,19,23).
What are the key properties of 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide?
4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-1,2-oxazol-3-yl)-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 113112335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).