1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol

C17H24O2 — CID 102649655

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol
SMILESCCC(C)C(c1ccccc1)C(O)C1=CCCCO1
InChIInChI=1S/C17H24O2/c1-3-13(2)16(14-9-5-4-6-10-14)17(18)15-11-7-8-12-19-15/h4-6,9-11,13,16-18H,3,7-8,12H2,1-2H3
InChIKeyZIOVXMHJJJKCLJ-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.87
Rot. Bonds5

About 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol

1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol (PubChem CID 102649655) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol
PubChem CID102649655
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol
SMILESCCC(C)C(c1ccccc1)C(O)C1=CCCCO1
InChIInChI=1S/C17H24O2/c1-3-13(2)16(14-9-5-4-6-10-14)17(18)15-11-7-8-12-19-15/h4-6,9-11,13,16-18H,3,7-8,12H2,1-2H3
InChIKeyZIOVXMHJJJKCLJ-UHFFFAOYSA-N
XLogP3.87
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(furan-2-yl)-3-methyl-2-phenylpentan-1-ol
CID 115797403
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxy-3-methylbutan-1-ol
CID 102654880
1-(3,4-dihydro-2H-pyran-6-yl)-3-methylbutane-1,2-diol
CID 103456632
2-(3-chlorophenoxy)-1-(3,4-dihydro-2H-pyran-6-yl)propan-1-ol
CID 102649827
2-butan-2-ylsulfanyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanamine
CID 102647531
1-(3,4-dihydro-2H-pyran-6-yl)octan-1-ol
CID 102646548
1-(2,3-dihydrofuran-5-yl)-3-methyl-2-phenylpentan-1-one
CID 102652750
N-ethyl-3-methyl-1,2-diphenylpentan-1-amine
CID 43489095
1-(3,4-dihydro-2H-pyran-6-yl)-N-methylpropan-1-amine
CID 102647204
6-methyl-5-phenyloct-1-yn-4-ol
CID 115839991
6-[1-(4-methylphenyl)ethyl]-3,4-dihydro-2H-pyran
CID 24744561
(4-tert-butylphenyl)-(3,4-dihydro-2H-pyran-6-yl)methanol
CID 102646462

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol (CID 102649655) is 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol is CCC(C)C(c1ccccc1)C(O)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol?
The InChIKey is ZIOVXMHJJJKCLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O2/c1-3-13(2)16(14-9-5-4-6-10-14)17(18)15-11-7-8-12-19-15/h4-6,9-11,13,16-18H,3,7-8,12H2,1-2H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol?
1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol has a molecular weight of 260.38 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)-3-methyl-2-phenylpentan-1-ol is sourced from PubChem (CID 102649655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).