3-methyl-1-(4-propylphenyl)pentan-1-ol

C15H24O — CID 114875906

IUPAC3-methyl-1-(4-propylphenyl)pentan-1-ol
SMILESCCCc1ccc(C(O)CC(C)CC)cc1
InChIInChI=1S/C15H24O/c1-4-6-13-7-9-14(10-8-13)15(16)11-12(3)5-2/h7-10,12,15-16H,4-6,11H2,1-3H3
InChIKeyUKZGLNIJMNPVSJ-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.11
Rot. Bonds6

About 3-methyl-1-(4-propylphenyl)pentan-1-ol

3-methyl-1-(4-propylphenyl)pentan-1-ol (PubChem CID 114875906) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 3-methyl-1-(4-propylphenyl)pentan-1-ol.

Molecular Properties

Compound Name3-methyl-1-(4-propylphenyl)pentan-1-ol
PubChem CID114875906
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name3-methyl-1-(4-propylphenyl)pentan-1-ol
SMILESCCCc1ccc(C(O)CC(C)CC)cc1
InChIInChI=1S/C15H24O/c1-4-6-13-7-9-14(10-8-13)15(16)11-12(3)5-2/h7-10,12,15-16H,4-6,11H2,1-3H3
InChIKeyUKZGLNIJMNPVSJ-UHFFFAOYSA-N
XLogP4.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-1-(4-phenylphenyl)pentan-1-ol
CID 65148669
2-(methylamino)-1-(4-propylphenyl)ethanol
CID 64988870
5-hydroxy-5-(4-propylphenyl)pentanoic acid
CID 43117855
5-(4-propylphenyl)hexane-2,3-diol
CID 83921595
1-[4-(difluoromethoxy)phenyl]-3-methylpentan-1-ol
CID 65150516
1-(1-chloropropyl)-4-propylbenzene
CID 63432383
1-(4-butylphenyl)butan-1-ol
CID 61088483
3-amino-5-methoxy-1-(4-propylphenyl)pentan-1-ol
CID 103967383
4,4-dimethyl-1-(4-propylphenyl)pentan-1-ol
CID 114211492
3-(methylamino)-1-(4-propylphenyl)propan-1-ol
CID 112509803
N'-methyl-N'-(2-methylbutyl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 43295696
2-(3,5-difluorophenyl)-1-(4-propylphenyl)ethanol
CID 62800447

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(4-propylphenyl)pentan-1-ol?
The IUPAC name of 3-methyl-1-(4-propylphenyl)pentan-1-ol (CID 114875906) is 3-methyl-1-(4-propylphenyl)pentan-1-ol.
What is the SMILES notation for 3-methyl-1-(4-propylphenyl)pentan-1-ol?
The canonical SMILES for 3-methyl-1-(4-propylphenyl)pentan-1-ol is CCCc1ccc(C(O)CC(C)CC)cc1.
What is the InChIKey of 3-methyl-1-(4-propylphenyl)pentan-1-ol?
The InChIKey is UKZGLNIJMNPVSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-4-6-13-7-9-14(10-8-13)15(16)11-12(3)5-2/h7-10,12,15-16H,4-6,11H2,1-3H3.
What are the key properties of 3-methyl-1-(4-propylphenyl)pentan-1-ol?
3-methyl-1-(4-propylphenyl)pentan-1-ol has a molecular weight of 220.36 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(4-propylphenyl)pentan-1-ol is sourced from PubChem (CID 114875906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).