2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole

C15H25N3O — CID 106389937

IUPAC2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole
SMILESCc1cnc(C(C)N2CC(C)(C3CC3)NCC2C)o1
InChIInChI=1S/C15H25N3O/c1-10-7-17-15(4,13-5-6-13)9-18(10)12(3)14-16-8-11(2)19-14/h8,10,12-13,17H,5-7,9H2,1-4H3
InChIKeyLSCRLSIISSMMAL-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.51
Rot. Bonds3

About 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole

2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole (PubChem CID 106389937) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole.

Molecular Properties

Compound Name2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole
PubChem CID106389937
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole
SMILESCc1cnc(C(C)N2CC(C)(C3CC3)NCC2C)o1
InChIInChI=1S/C15H25N3O/c1-10-7-17-15(4,13-5-6-13)9-18(10)12(3)14-16-8-11(2)19-14/h8,10,12-13,17H,5-7,9H2,1-4H3
InChIKeyLSCRLSIISSMMAL-UHFFFAOYSA-N
XLogP2.51
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl N-[1-[(5-methyl-1,3-oxazol-2-yl)methyl]piperidin-4-yl]carbamate
CID 75374923
(3S)-3-methyl-4-[(5-methyl-1,3-oxazol-2-yl)methyl]-3-propylpiperazin-2-one
CID 99823808
2-[1-(3-Fluoro-3-methylpiperidin-1-yl)ethyl]-5-methyl-1,3-oxazole
CID 126790332
N-(3-bicyclo[3.1.0]hexanyl)-5-methyl-1,3-oxazole-2-carboxamide
CID 128882272
5-Methyl-2-[1-(3-pyrrolidin-1-ylpiperidin-1-yl)ethyl]-1,3-oxazole
CID 132283984
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 102672927
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 103096714
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 103096788
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 103893621
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-(trifluoromethyl)cyclohexan-1-amine
CID 104696223
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 104862556
6,6,6-trifluoro-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]hexan-2-amine
CID 104928143

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole?
The IUPAC name of 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole (CID 106389937) is 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole.
What is the SMILES notation for 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole?
The canonical SMILES for 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole is Cc1cnc(C(C)N2CC(C)(C3CC3)NCC2C)o1.
What is the InChIKey of 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole?
The InChIKey is LSCRLSIISSMMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-10-7-17-15(4,13-5-6-13)9-18(10)12(3)14-16-8-11(2)19-14/h8,10,12-13,17H,5-7,9H2,1-4H3.
What are the key properties of 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole?
2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole has a molecular weight of 263.38 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole is sourced from PubChem (CID 106389937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).