(2R)-2-(2-methylpropyl)oxane

C9H18O — CID 58653197

IUPAC(2R)-2-(2-methylpropyl)oxane
SMILESCC(C)C[C@H]1CCCCO1
InChIInChI=1S/C9H18O/c1-8(2)7-9-5-3-4-6-10-9/h8-9H,3-7H2,1-2H3/t9-/m1/s1
InChIKeyDGTFZOUSVFPLJH-SECBINFHSA-N
MW142.24 g/mol
LogP2.60
Rot. Bonds2

About (2R)-2-(2-methylpropyl)oxane

(2R)-2-(2-methylpropyl)oxane (PubChem CID 58653197) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is (2R)-2-(2-methylpropyl)oxane.

Molecular Properties

Compound Name(2R)-2-(2-methylpropyl)oxane
PubChem CID58653197
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name(2R)-2-(2-methylpropyl)oxane
SMILESCC(C)C[C@H]1CCCCO1
InChIInChI=1S/C9H18O/c1-8(2)7-9-5-3-4-6-10-9/h8-9H,3-7H2,1-2H3/t9-/m1/s1
InChIKeyDGTFZOUSVFPLJH-SECBINFHSA-N
XLogP2.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3-dimethylbutyl)oxane
CID 167069415
(2R)-1-(oxolan-2-yl)propan-2-amine
CID 104932128
5-methyl-1-(oxolan-2-yl)hexan-2-amine
CID 62599893
(2S)-2-(3-chloro-2-methylpropyl)oxolane
CID 165447123
N-methyl-1-(oxolan-2-yl)propan-2-amine
CID 60819551
2-(3-bromo-2-methylpropyl)oxolane
CID 66049606
2-(oxan-2-ylmethyl)oxane
CID 67860654
3-fluoro-4-(oxan-2-yl)butan-2-one
CID 105435805
2-fluoro-3-(oxan-2-yl)propanal
CID 105431408
(2R)-4-[(2R)-oxan-2-yl]butan-2-ol
CID 11171126
2,5-bis[1-(oxolan-2-yl)propan-2-yl]oxolane
CID 54185574
2-(3-bromo-2-fluoropropyl)oxane
CID 122239838

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-methylpropyl)oxane?
The IUPAC name of (2R)-2-(2-methylpropyl)oxane (CID 58653197) is (2R)-2-(2-methylpropyl)oxane.
What is the SMILES notation for (2R)-2-(2-methylpropyl)oxane?
The canonical SMILES for (2R)-2-(2-methylpropyl)oxane is CC(C)C[C@H]1CCCCO1.
What is the InChIKey of (2R)-2-(2-methylpropyl)oxane?
The InChIKey is DGTFZOUSVFPLJH-SECBINFHSA-N. The full InChI is InChI=1S/C9H18O/c1-8(2)7-9-5-3-4-6-10-9/h8-9H,3-7H2,1-2H3/t9-/m1/s1.
What are the key properties of (2R)-2-(2-methylpropyl)oxane?
(2R)-2-(2-methylpropyl)oxane has a molecular weight of 142.24 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-methylpropyl)oxane is sourced from PubChem (CID 58653197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).