1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol

C15H20O2 — CID 104769122

IUPAC1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol
SMILESOC1(CC2CCOc3ccccc32)CCCC1
InChIInChI=1S/C15H20O2/c16-15(8-3-4-9-15)11-12-7-10-17-14-6-2-1-5-13(12)14/h1-2,5-6,12,16H,3-4,7-11H2
InChIKeyBFBNSOHCCDFZQZ-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.25
Rot. Bonds2

About 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol

1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol (PubChem CID 104769122) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol
PubChem CID104769122
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol
SMILESOC1(CC2CCOc3ccccc32)CCCC1
InChIInChI=1S/C15H20O2/c16-15(8-3-4-9-15)11-12-7-10-17-14-6-2-1-5-13(12)14/h1-2,5-6,12,16H,3-4,7-11H2
InChIKeyBFBNSOHCCDFZQZ-UHFFFAOYSA-N
XLogP3.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dihydro-2H-chromen-4-ylmethyl)-4,4-dimethylcycloheptan-1-ol
CID 104769272
4-(3,4-dihydro-2H-chromen-4-ylmethyl)-1-methylazepan-4-ol
CID 104769267
3-cyclopropyl-1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclohexan-1-ol
CID 104769260
1-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-(ethylamino)cyclohexan-1-ol
CID 104772399
1-(3,4-dihydro-2H-chromen-4-ylmethyl)-3-ethylcyclopentan-1-ol
CID 104769259
1-(3,4-dihydro-2H-chromen-4-yl)-3-[(1-hydroxycyclohexyl)methyl]urea
CID 110936462
[1-(3,4-dihydro-2H-chromen-4-ylmethylamino)cyclopentyl]methanol
CID 115924343
[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887493
[(4S)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887495
(4R)-4-(iodomethyl)-3,4-dihydro-2H-chromene
CID 92908096
2-(3,4-dihydro-2H-chromen-4-yl)-1-(1-ethoxycyclopentyl)ethanone
CID 116747763
1-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 104769683

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol?
The IUPAC name of 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol (CID 104769122) is 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol.
What is the SMILES notation for 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol?
The canonical SMILES for 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol is OC1(CC2CCOc3ccccc32)CCCC1.
What is the InChIKey of 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol?
The InChIKey is BFBNSOHCCDFZQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c16-15(8-3-4-9-15)11-12-7-10-17-14-6-2-1-5-13(12)14/h1-2,5-6,12,16H,3-4,7-11H2.
What are the key properties of 1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol?
1-(3,4-dihydro-2H-chromen-4-ylmethyl)cyclopentan-1-ol has a molecular weight of 232.32 g/mol, XLogP of 3.25, 2 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-chromen-4-ylmethyl)cyclopentan-1-ol is sourced from PubChem (CID 104769122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).