1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone

C15H24N4O3 — CID 119399315

IUPAC1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone
SMILESCc1cc(CN2CCN(C(=O)CC3CNCCO3)CC2)on1
InChIInChI=1S/C15H24N4O3/c1-12-8-14(22-17-12)11-18-3-5-19(6-4-18)15(20)9-13-10-16-2-7-21-13/h8,13,16H,2-7,9-11H2,1H3
InChIKeyHOSSNHLSRFPCHQ-UHFFFAOYSA-N
MW308.38 g/mol
LogP0.01
Rot. Bonds4

About 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone

1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone (PubChem CID 119399315) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone.

Molecular Properties

Compound Name1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone
PubChem CID119399315
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC Name1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone
SMILESCc1cc(CN2CCN(C(=O)CC3CNCCO3)CC2)on1
InChIInChI=1S/C15H24N4O3/c1-12-8-14(22-17-12)11-18-3-5-19(6-4-18)15(20)9-13-10-16-2-7-21-13/h8,13,16H,2-7,9-11H2,1H3
InChIKeyHOSSNHLSRFPCHQ-UHFFFAOYSA-N
XLogP0.01
TPSA70.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone?
The IUPAC name of 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone (CID 119399315) is 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone.
What is the SMILES notation for 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone?
The canonical SMILES for 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone is Cc1cc(CN2CCN(C(=O)CC3CNCCO3)CC2)on1.
What is the InChIKey of 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone?
The InChIKey is HOSSNHLSRFPCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-12-8-14(22-17-12)11-18-3-5-19(6-4-18)15(20)9-13-10-16-2-7-21-13/h8,13,16H,2-7,9-11H2,1H3.
What are the key properties of 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone?
1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone has a molecular weight of 308.38 g/mol, XLogP of 0.01, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-2-morpholin-2-ylethanone is sourced from PubChem (CID 119399315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).