2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol

C14H22O — CID 66025238

IUPAC2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol
SMILESCCCC(C)(CO)Cc1ccccc1C
InChIInChI=1S/C14H22O/c1-4-9-14(3,11-15)10-13-8-6-5-7-12(13)2/h5-8,15H,4,9-11H2,1-3H3
InChIKeyCXMKYYRGXQGGOV-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.34
Rot. Bonds5

About 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol

2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol (PubChem CID 66025238) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol.

Molecular Properties

Compound Name2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol
PubChem CID66025238
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol
SMILESCCCC(C)(CO)Cc1ccccc1C
InChIInChI=1S/C14H22O/c1-4-9-14(3,11-15)10-13-8-6-5-7-12(13)2/h5-8,15H,4,9-11H2,1-3H3
InChIKeyCXMKYYRGXQGGOV-UHFFFAOYSA-N
XLogP3.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2-methylphenyl)methyl]-2-propylpropane-1,3-diol
CID 79450994
1-(2,2-dimethylpropyl)-2-methylbenzene
CID 21464495
CID 154678326
CID 154678326
2-methyl-2-[(2-methylphenyl)methyl]pentanoic acid
CID 62738371
2-methyl-2-[(2-methylphenyl)methylamino]pentan-1-ol
CID 111432021
2-methyl-1-(2-methylphenyl)propane-2-thiol
CID 10583708
2,3-dimethyl-2-[(2-methylphenyl)methyl]butan-1-ol
CID 83151379
2,3,3-trimethyl-4-(2-methylphenyl)butan-2-ol
CID 58555255
2-[(2-chlorophenyl)methyl]-2-methylbutan-1-ol
CID 66060666
3,3-dimethyl-4-(2-methylphenyl)-N-propylbutan-1-amine
CID 81023143
2-[(2-chloro-4-fluorophenyl)methyl]-2-methylpentan-1-ol
CID 66025240
N-tert-butyl-N-[(2-methylphenyl)methyl]hydroxylamine
CID 90735302

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol?
The IUPAC name of 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol (CID 66025238) is 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol.
What is the SMILES notation for 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol?
The canonical SMILES for 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol is CCCC(C)(CO)Cc1ccccc1C.
What is the InChIKey of 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol?
The InChIKey is CXMKYYRGXQGGOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-4-9-14(3,11-15)10-13-8-6-5-7-12(13)2/h5-8,15H,4,9-11H2,1-3H3.
What are the key properties of 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol?
2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol has a molecular weight of 206.33 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(2-methylphenyl)methyl]pentan-1-ol is sourced from PubChem (CID 66025238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).