1-cyclopentyl-3-hydroxypentan-2-one

C10H18O2 — CID 103452923

IUPAC1-cyclopentyl-3-hydroxypentan-2-one
SMILESCCC(O)C(=O)CC1CCCC1
InChIInChI=1S/C10H18O2/c1-2-9(11)10(12)7-8-5-3-4-6-8/h8-9,11H,2-7H2,1H3
InChIKeyRBKZGOOTMLMBON-UHFFFAOYSA-N
MW170.25 g/mol
LogP1.91
Rot. Bonds4

About 1-cyclopentyl-3-hydroxypentan-2-one

1-cyclopentyl-3-hydroxypentan-2-one (PubChem CID 103452923) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 1-cyclopentyl-3-hydroxypentan-2-one.

Molecular Properties

Compound Name1-cyclopentyl-3-hydroxypentan-2-one
PubChem CID103452923
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name1-cyclopentyl-3-hydroxypentan-2-one
SMILESCCC(O)C(=O)CC1CCCC1
InChIInChI=1S/C10H18O2/c1-2-9(11)10(12)7-8-5-3-4-6-8/h8-9,11H,2-7H2,1H3
InChIKeyRBKZGOOTMLMBON-UHFFFAOYSA-N
XLogP1.91
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-3-ethylpentan-2-one
CID 114967631
1-cyclopentyl-3-hydroxybutan-2-one
CID 103451317
3-(aminomethyl)-1-cyclohexylpentan-2-one
CID 116575171
(3R)-3-amino-1-cyclohexyl-4-methylpentan-2-one
CID 58418389
4-cyclopentyl-2-methyl-3-oxobutanenitrile
CID 60758153
3-cyclopentyl-1-cyclopropyl-1-methoxypropan-2-one
CID 116709029
2-(2-cyclopentylacetyl)propanedinitrile
CID 112732082
1,1-dibromo-3-cyclopropylpropan-2-one
CID 91443105
1-cyclohexadecylpropan-2-one
CID 175123721
1-cyclohexyl-4-methyl-3-phenylhexan-2-one
CID 114967641
3-amino-1-cyclobutyl-4-sulfanylbutan-2-one
CID 149468421
1-cyclobutyl-3-methoxybutan-2-one
CID 79616644

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-hydroxypentan-2-one?
The IUPAC name of 1-cyclopentyl-3-hydroxypentan-2-one (CID 103452923) is 1-cyclopentyl-3-hydroxypentan-2-one.
What is the SMILES notation for 1-cyclopentyl-3-hydroxypentan-2-one?
The canonical SMILES for 1-cyclopentyl-3-hydroxypentan-2-one is CCC(O)C(=O)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-hydroxypentan-2-one?
The InChIKey is RBKZGOOTMLMBON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-2-9(11)10(12)7-8-5-3-4-6-8/h8-9,11H,2-7H2,1H3.
What are the key properties of 1-cyclopentyl-3-hydroxypentan-2-one?
1-cyclopentyl-3-hydroxypentan-2-one has a molecular weight of 170.25 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-hydroxypentan-2-one is sourced from PubChem (CID 103452923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).