4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole

C14H24N2O2 — CID 57185240

IUPAC4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole
SMILESCCCCC(C)(C1=NC(C)CO1)C1=NC(C)CO1
InChIInChI=1S/C14H24N2O2/c1-5-6-7-14(4,12-15-10(2)8-17-12)13-16-11(3)9-18-13/h10-11H,5-9H2,1-4H3
InChIKeyFXUGELDLFAYXMF-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.82
Rot. Bonds5

About 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole

4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole (PubChem CID 57185240) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole
PubChem CID57185240
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole
SMILESCCCCC(C)(C1=NC(C)CO1)C1=NC(C)CO1
InChIInChI=1S/C14H24N2O2/c1-5-6-7-14(4,12-15-10(2)8-17-12)13-16-11(3)9-18-13/h10-11H,5-9H2,1-4H3
InChIKeyFXUGELDLFAYXMF-UHFFFAOYSA-N
XLogP2.82
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole with MolForge

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Related Compounds

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CID 688210
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CID 495276
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CID 688205
CID 688205
CID 10880944
CID 10880944
CID 11821563
CID 11821563
CID 3479933
CID 3479933
CID 372806
CID 372806
CID 495275
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CID 10639448
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CID 10891732
CID 10891732

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole?
The IUPAC name of 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole (CID 57185240) is 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole?
The canonical SMILES for 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole is CCCCC(C)(C1=NC(C)CO1)C1=NC(C)CO1.
What is the InChIKey of 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole?
The InChIKey is FXUGELDLFAYXMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-5-6-7-14(4,12-15-10(2)8-17-12)13-16-11(3)9-18-13/h10-11H,5-9H2,1-4H3.
What are the key properties of 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole?
4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole has a molecular weight of 252.36 g/mol, XLogP of 2.82, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[2-(4-methyl-4,5-dihydro-1,3-oxazol-2-yl)hexan-2-yl]-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 57185240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).