4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol

C15H23NO2 — CID 114192018

IUPAC4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol
SMILESCOc1ccc(CC(O)CCC2CCCC2)cn1
InChIInChI=1S/C15H23NO2/c1-18-15-9-7-13(11-16-15)10-14(17)8-6-12-4-2-3-5-12/h7,9,11-12,14,17H,2-6,8,10H2,1H3
InChIKeyNADNLGRNJCZAKE-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.96
Rot. Bonds6

About 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol

4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol (PubChem CID 114192018) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol.

Molecular Properties

Compound Name4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol
PubChem CID114192018
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol
SMILESCOc1ccc(CC(O)CCC2CCCC2)cn1
InChIInChI=1S/C15H23NO2/c1-18-15-9-7-13(11-16-15)10-14(17)8-6-12-4-2-3-5-12/h7,9,11-12,14,17H,2-6,8,10H2,1H3
InChIKeyNADNLGRNJCZAKE-UHFFFAOYSA-N
XLogP2.96
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-cyclohexyl-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250515
[1-cyclobutyl-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250610
cyclohexylmethyl-[2-hydroxy-3-[(6-methoxy-3-pyridinyl)methylamino]propyl]phosphinic acid
CID 68531106
4-cyclopentyl-1-[4-(trifluoromethoxy)phenyl]butan-2-ol
CID 115787298
4-cyclopentyl-1-(3-methylphenyl)butan-2-ol
CID 55149919
4-cyclohexyl-1-(3,5-dimethylphenyl)butan-2-ol
CID 114980328
1-(3-cyclopentylpropyl)-3-[(6-methoxy-3-pyridinyl)methyl]-2-methylguanidine
CID 111946769
N-cyclopentyloxy-1-(6-methoxy-3-pyridinyl)methanamine
CID 114936879
1-(6-methoxy-3-pyridinyl)-3-(1-methylpyrazol-3-yl)propan-2-ol
CID 82870030
1-(3-cyclopentylpropyl)-3-ethyl-2-[(6-methoxy-3-pyridinyl)methyl]guanidine
CID 111946373
1-(5-bromo-2-methoxyphenyl)-4-cyclopentylbutan-2-ol
CID 115779341
1-(3-chloro-4-fluorophenyl)-4-cyclopentylbutan-2-ol
CID 103043661

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol?
The IUPAC name of 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol (CID 114192018) is 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol.
What is the SMILES notation for 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol?
The canonical SMILES for 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol is COc1ccc(CC(O)CCC2CCCC2)cn1.
What is the InChIKey of 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol?
The InChIKey is NADNLGRNJCZAKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-18-15-9-7-13(11-16-15)10-14(17)8-6-12-4-2-3-5-12/h7,9,11-12,14,17H,2-6,8,10H2,1H3.
What are the key properties of 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol?
4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol has a molecular weight of 249.35 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-1-(6-methoxy-3-pyridinyl)butan-2-ol is sourced from PubChem (CID 114192018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).