(2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol

C10H22O — CID 167343792

IUPAC(2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol
SMILESCC(C)[C@H](CO)CC(C)(C)C
InChIInChI=1S/C10H22O/c1-8(2)9(7-11)6-10(3,4)5/h8-9,11H,6-7H2,1-5H3/t9-/m0/s1
InChIKeyROXTYVGYLBOJPP-VIFPVBQESA-N
MW158.28 g/mol
LogP2.69
Rot. Bonds3

About (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol

(2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol (PubChem CID 167343792) has the molecular formula C10H22O and a molecular weight of 158.28 g/mol. Its IUPAC name is (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol.

Molecular Properties

Compound Name(2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol
PubChem CID167343792
Molecular FormulaC10H22O
Molecular Weight158.28 g/mol
Exact Mass158.17
IUPAC Name(2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol
SMILESCC(C)[C@H](CO)CC(C)(C)C
InChIInChI=1S/C10H22O/c1-8(2)9(7-11)6-10(3,4)5/h8-9,11H,6-7H2,1-5H3/t9-/m0/s1
InChIKeyROXTYVGYLBOJPP-VIFPVBQESA-N
XLogP2.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.28
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5,5-dimethyl-2-propan-2-ylhexan-1-ol
CID 66057517
2-[[amino(methyl)amino]methyl]-3-methylbutan-1-ol
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4-tert-butyl-5-(2,2-dimethylpropyl)-2,2,7,7-tetramethyloctane
CID 153293679
(3R)-2,5,5-trimethylhexan-3-ol
CID 167343865
2,2,7,7-tetramethyl-4-propan-2-ylnonane
CID 123845621
(2R)-4,4-dimethylpentan-2-ol
CID 7014873
[(2R)-1-hydroxy-4,4-dimethylpentan-2-yl]azanium
CID 140963975
2-propan-2-ylpentane-1,4-diol
CID 22619698
2-(2-chloroethyl)-5,5-dimethylhexane-1,3-diol
CID 141415271
(2R,3S,4R)-2,6,6-trimethylheptane-1,3,4-triol
CID 88965290
2-(2-tert-butylsulfonylethyl)-3-methylbutan-1-ol
CID 106734343
ethane;2,2,4,6,6-pentamethylheptane
CID 142211592

Frequently Asked Questions

What is the IUPAC name of (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol?
The IUPAC name of (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol (CID 167343792) is (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol.
What is the SMILES notation for (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol?
The canonical SMILES for (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol is CC(C)[C@H](CO)CC(C)(C)C.
What is the InChIKey of (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol?
The InChIKey is ROXTYVGYLBOJPP-VIFPVBQESA-N. The full InChI is InChI=1S/C10H22O/c1-8(2)9(7-11)6-10(3,4)5/h8-9,11H,6-7H2,1-5H3/t9-/m0/s1.
What are the key properties of (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol?
(2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol has a molecular weight of 158.28 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4,4-dimethyl-2-propan-2-ylpentan-1-ol is sourced from PubChem (CID 167343792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).