2-(3-methylphenyl)propan-1-ol

C10H14O — CID 21478686

IUPAC2-(3-methylphenyl)propan-1-ol
SMILESCc1cccc(C(C)CO)c1
InChIInChI=1S/C10H14O/c1-8-4-3-5-10(6-8)9(2)7-11/h3-6,9,11H,7H2,1-2H3
InChIKeyRMKUOUCSEVQHSS-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.09
Rot. Bonds2

About 2-(3-methylphenyl)propan-1-ol

2-(3-methylphenyl)propan-1-ol (PubChem CID 21478686) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is 2-(3-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(3-methylphenyl)propan-1-ol
PubChem CID21478686
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name2-(3-methylphenyl)propan-1-ol
SMILESCc1cccc(C(C)CO)c1
InChIInChI=1S/C10H14O/c1-8-4-3-5-10(6-8)9(2)7-11/h3-6,9,11H,7H2,1-2H3
InChIKeyRMKUOUCSEVQHSS-UHFFFAOYSA-N
XLogP2.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-methylphenyl)pentan-2-amine
CID 64719404
(3S)-3-(3-methylphenyl)butanenitrile
CID 102340136
1-(1-methoxypropan-2-yl)-3-methylbenzene
CID 88998801
hydrogen peroxide;bis(1-methyl-3-propan-2-ylbenzene)
CID 172708535
1-[(2S)-hexan-2-yl]-3-methylbenzene
CID 177146416
(2S)-3-amino-2-(3-methylphenyl)propan-1-ol
CID 86327369
3-amino-2-(3-methylphenyl)propan-1-ol
CID 46911824
2-(3-methylphenyl)-2-(2-methylpropylamino)ethanol
CID 61055543
2-azido-2-(3-methylphenyl)ethanol
CID 150053824
2-cyclopropyl-2-(3-methylphenyl)ethanol
CID 104819581
2-aminooxy-2-(3-methylphenyl)ethanol
CID 105433392
ethane;(2R)-2-phenylpropan-1-ol
CID 160644449

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)propan-1-ol?
The IUPAC name of 2-(3-methylphenyl)propan-1-ol (CID 21478686) is 2-(3-methylphenyl)propan-1-ol.
What is the SMILES notation for 2-(3-methylphenyl)propan-1-ol?
The canonical SMILES for 2-(3-methylphenyl)propan-1-ol is Cc1cccc(C(C)CO)c1.
What is the InChIKey of 2-(3-methylphenyl)propan-1-ol?
The InChIKey is RMKUOUCSEVQHSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O/c1-8-4-3-5-10(6-8)9(2)7-11/h3-6,9,11H,7H2,1-2H3.
What are the key properties of 2-(3-methylphenyl)propan-1-ol?
2-(3-methylphenyl)propan-1-ol has a molecular weight of 150.22 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)propan-1-ol is sourced from PubChem (CID 21478686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).