1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol

C14H20O — CID 64919325

IUPAC1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol
SMILESCCC(O)(c1ccc(C)cc1C)C1CC1
InChIInChI=1S/C14H20O/c1-4-14(15,12-6-7-12)13-8-5-10(2)9-11(13)3/h5,8-9,12,15H,4,6-7H2,1-3H3
InChIKeyWVDHFLMQOKEXOM-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.31
Rot. Bonds3

About 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol

1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol (PubChem CID 64919325) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol.

Molecular Properties

Compound Name1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol
PubChem CID64919325
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol
SMILESCCC(O)(c1ccc(C)cc1C)C1CC1
InChIInChI=1S/C14H20O/c1-4-14(15,12-6-7-12)13-8-5-10(2)9-11(13)3/h5,8-9,12,15H,4,6-7H2,1-3H3
InChIKeyWVDHFLMQOKEXOM-UHFFFAOYSA-N
XLogP3.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopropyl-1-(2,4-dimethylphenyl)ethanol
CID 62801339
1-cyclopropyl-1-(2,3-difluoro-4-methylphenyl)propan-1-ol
CID 107512247
1-amino-2-(2,4-dimethylphenyl)butan-2-ol
CID 79002052
1-cyclopropyl-1-(4-fluoro-3-methylphenyl)propan-1-ol
CID 64918280
1-cyclopropyl-1-(2-fluorophenyl)propan-1-ol
CID 64918927
1-cyclopropyl-1-(3-fluoro-4-methylphenyl)propan-1-ol
CID 107128071
1-(1,1-difluoropropyl)-2,4-dimethylbenzene
CID 116841228
1-cycloheptyl-1-(2-fluorophenyl)propan-1-ol
CID 112679495
2-(2,4-dimethylphenyl)-2-hydroxy-N-methylbutanamide
CID 91457472
(2R)-2-(2,5-dimethylphenyl)butan-2-ol
CID 94334052
(2,4-dimethylphenyl)-bis(4-methylphenyl)methanol
CID 54297310
1-[1,1-bis(2,4-dimethylphenyl)ethyl]-2,4-dimethylbenzene
CID 19090109

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol?
The IUPAC name of 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol (CID 64919325) is 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol.
What is the SMILES notation for 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol?
The canonical SMILES for 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol is CCC(O)(c1ccc(C)cc1C)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol?
The InChIKey is WVDHFLMQOKEXOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-4-14(15,12-6-7-12)13-8-5-10(2)9-11(13)3/h5,8-9,12,15H,4,6-7H2,1-3H3.
What are the key properties of 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol?
1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol has a molecular weight of 204.31 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(2,4-dimethylphenyl)propan-1-ol is sourced from PubChem (CID 64919325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).