5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole

C19H25N5O — CID 126893542

IUPAC5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole
SMILESc1ccc(N2CCN(C3CN(Cc4ncc(C5CC5)o4)C3)CC2)nc1
InChIInChI=1S/C19H25N5O/c1-2-6-20-18(3-1)24-9-7-23(8-10-24)16-12-22(13-16)14-19-21-11-17(25-19)15-4-5-15/h1-3,6,11,15-16H,4-5,7-10,12-14H2
InChIKeyBWOPPWWBPHVBGS-UHFFFAOYSA-N
MW339.44 g/mol
LogP1.95
Rot. Bonds5

About 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole

5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole (PubChem CID 126893542) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole.

Molecular Properties

Compound Name5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole
PubChem CID126893542
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole
SMILESc1ccc(N2CCN(C3CN(Cc4ncc(C5CC5)o4)C3)CC2)nc1
InChIInChI=1S/C19H25N5O/c1-2-6-20-18(3-1)24-9-7-23(8-10-24)16-12-22(13-16)14-19-21-11-17(25-19)15-4-5-15/h1-3,6,11,15-16H,4-5,7-10,12-14H2
InChIKeyBWOPPWWBPHVBGS-UHFFFAOYSA-N
XLogP1.95
TPSA48.64 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole with MolForge

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Related Compounds

5-cyclopropyl-2-[[3-[4-(4-fluorophenyl)piperazin-1-yl]azetidin-1-yl]methyl]-1,3-oxazole
CID 126893083
5-cyclopropyl-3-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,2,4-oxadiazole
CID 126893518
2-cyclopropyl-4-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]pyrimidine
CID 126893499
1-[1-[(2-methyltriazol-4-yl)methyl]azetidin-3-yl]-4-pyridin-2-ylpiperazine
CID 126893462
5-cyclopropyl-2-[(3-pyrazol-1-ylazetidin-1-yl)methyl]-1,3-oxazole
CID 126900314
2-cyclopropyl-5-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,4-oxadiazole
CID 47520575
1-pyridin-2-yl-4-[1-[2-(triazol-2-yl)ethyl]azetidin-3-yl]piperazine
CID 126893461
2-methyl-5-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]pyridazin-3-one
CID 126893477
1-methyl-4-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]pyridin-2-one
CID 126893507
1-(1-cyclohexylazetidin-3-yl)-4-pyridin-2-ylpiperazine
CID 126893395
3-(4-pyridin-2-ylpiperazin-1-yl)azetidine-1-carbaldehyde
CID 123583794
4-(4-pyridin-2-ylpiperazin-1-yl)cyclohexan-1-amine
CID 15045421

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole?
The IUPAC name of 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole (CID 126893542) is 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole.
What is the SMILES notation for 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole?
The canonical SMILES for 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole is c1ccc(N2CCN(C3CN(Cc4ncc(C5CC5)o4)C3)CC2)nc1.
What is the InChIKey of 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole?
The InChIKey is BWOPPWWBPHVBGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-2-6-20-18(3-1)24-9-7-23(8-10-24)16-12-22(13-16)14-19-21-11-17(25-19)15-4-5-15/h1-3,6,11,15-16H,4-5,7-10,12-14H2.
What are the key properties of 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole?
5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole has a molecular weight of 339.44 g/mol, XLogP of 1.95, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-[[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]methyl]-1,3-oxazole is sourced from PubChem (CID 126893542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).