(2R)-2-benzyl-3-methylpentan-1-ol

C13H20O — CID 15214035

IUPAC(2R)-2-benzyl-3-methylpentan-1-ol
SMILESCCC(C)[C@H](CO)Cc1ccccc1
InChIInChI=1S/C13H20O/c1-3-11(2)13(10-14)9-12-7-5-4-6-8-12/h4-8,11,13-14H,3,9-10H2,1-2H3/t11?,13-/m0/s1
InChIKeyACPCVMMHTXONGW-YUZLPWPTSA-N
MW192.30 g/mol
LogP2.88
Rot. Bonds5

About (2R)-2-benzyl-3-methylpentan-1-ol

(2R)-2-benzyl-3-methylpentan-1-ol (PubChem CID 15214035) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is (2R)-2-benzyl-3-methylpentan-1-ol.

Molecular Properties

Compound Name(2R)-2-benzyl-3-methylpentan-1-ol
PubChem CID15214035
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name(2R)-2-benzyl-3-methylpentan-1-ol
SMILESCCC(C)[C@H](CO)Cc1ccccc1
InChIInChI=1S/C13H20O/c1-3-11(2)13(10-14)9-12-7-5-4-6-8-12/h4-8,11,13-14H,3,9-10H2,1-2H3/t11?,13-/m0/s1
InChIKeyACPCVMMHTXONGW-YUZLPWPTSA-N
XLogP2.88
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dibenzylpentane-1,4-diol
CID 86084378
[(2S)-2-ethyl-3-methylbutyl]benzene
CID 59911229
(2S,3S)-3-benzylbutane-1,2,4-triol
CID 13198346
ethane;(2-ethyl-3-methylbutyl)benzene
CID 166139706
(2S,3S)-3-benzylpentan-2-amine
CID 93427085
(2-benzyl-3-methylbutyl)benzene
CID 22277918
[(2S)-2-(2-methoxypropan-2-yloxymethyl)-3-methylpentyl]benzene
CID 100977400
3-methyl-2-phenylmethoxypentan-1-ol
CID 123785184
(2S,3S)-3-methyl-4-phenylbutan-2-ol
CID 11194521
(2S)-2-amino-3-hydroxypropanoic acid;(2S,3S)-2-amino-3-methylpentanoic acid;bis((2S)-2-amino-3-phenylpropanoic acid)
CID 68665630
hydrogen peroxide;1-phenylbutan-2-ylbenzene
CID 19777291
4-benzyl-2-methylhexan-3-amine
CID 79299139

Frequently Asked Questions

What is the IUPAC name of (2R)-2-benzyl-3-methylpentan-1-ol?
The IUPAC name of (2R)-2-benzyl-3-methylpentan-1-ol (CID 15214035) is (2R)-2-benzyl-3-methylpentan-1-ol.
What is the SMILES notation for (2R)-2-benzyl-3-methylpentan-1-ol?
The canonical SMILES for (2R)-2-benzyl-3-methylpentan-1-ol is CCC(C)[C@H](CO)Cc1ccccc1.
What is the InChIKey of (2R)-2-benzyl-3-methylpentan-1-ol?
The InChIKey is ACPCVMMHTXONGW-YUZLPWPTSA-N. The full InChI is InChI=1S/C13H20O/c1-3-11(2)13(10-14)9-12-7-5-4-6-8-12/h4-8,11,13-14H,3,9-10H2,1-2H3/t11?,13-/m0/s1.
What are the key properties of (2R)-2-benzyl-3-methylpentan-1-ol?
(2R)-2-benzyl-3-methylpentan-1-ol has a molecular weight of 192.30 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-benzyl-3-methylpentan-1-ol is sourced from PubChem (CID 15214035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).