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

C16H25N5O4 — CID 42937214

IUPACN-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide
SMILESCc1cc(NC(=O)C(C)N2CCN(C(=O)N3CCOCC3)CC2)on1
InChIInChI=1S/C16H25N5O4/c1-12-11-14(25-18-12)17-15(22)13(2)19-3-5-20(6-4-19)16(23)21-7-9-24-10-8-21/h11,13H,3-10H2,1-2H3,(H,17,22)
InChIKeyWWJIREOOPXTLRG-UHFFFAOYSA-N
MW351.41 g/mol
LogP0.38
Rot. Bonds3

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

N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide (PubChem CID 42937214) has the molecular formula C16H25N5O4 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide
PubChem CID42937214
Molecular FormulaC16H25N5O4
Molecular Weight351.41 g/mol
Exact Mass351.19
IUPAC NameN-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide
SMILESCc1cc(NC(=O)C(C)N2CCN(C(=O)N3CCOCC3)CC2)on1
InChIInChI=1S/C16H25N5O4/c1-12-11-14(25-18-12)17-15(22)13(2)19-3-5-20(6-4-19)16(23)21-7-9-24-10-8-21/h11,13H,3-10H2,1-2H3,(H,17,22)
InChIKeyWWJIREOOPXTLRG-UHFFFAOYSA-N
XLogP0.38
TPSA91.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide?
The IUPAC name of N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide (CID 42937214) is N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide is Cc1cc(NC(=O)C(C)N2CCN(C(=O)N3CCOCC3)CC2)on1.
What is the InChIKey of N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide?
The InChIKey is WWJIREOOPXTLRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O4/c1-12-11-14(25-18-12)17-15(22)13(2)19-3-5-20(6-4-19)16(23)21-7-9-24-10-8-21/h11,13H,3-10H2,1-2H3,(H,17,22).
What are the key properties of N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide?
N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide has a molecular weight of 351.41 g/mol, XLogP of 0.38, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 42937214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).