1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol

C16H29NO — CID 10286001

IUPAC1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol
SMILESOC1(C2CCCCC2)CCCC1CN1CCCC1
InChIInChI=1S/C16H29NO/c18-16(14-7-2-1-3-8-14)10-6-9-15(16)13-17-11-4-5-12-17/h14-15,18H,1-13H2
InChIKeyKPUYVVPBOCNQIS-UHFFFAOYSA-N
MW251.41 g/mol
LogP3.19
Rot. Bonds3

About 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol

1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol (PubChem CID 10286001) has the molecular formula C16H29NO and a molecular weight of 251.41 g/mol. Its IUPAC name is 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol.

Molecular Properties

Compound Name1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol
PubChem CID10286001
Molecular FormulaC16H29NO
Molecular Weight251.41 g/mol
Exact Mass251.22
IUPAC Name1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol
SMILESOC1(C2CCCCC2)CCCC1CN1CCCC1
InChIInChI=1S/C16H29NO/c18-16(14-7-2-1-3-8-14)10-6-9-15(16)13-17-11-4-5-12-17/h14-15,18H,1-13H2
InChIKeyKPUYVVPBOCNQIS-UHFFFAOYSA-N
XLogP3.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.41
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Cyclopentyl-2-(pyrrolidin-1-ylmethyl)cycloheptan-1-ol
CID 10125341
1-Cyclopentyl-2-(pyrrolidin-1-ylmethyl)cyclododecan-1-ol
CID 10193446
2-(Azepan-1-ylmethyl)-1-(cyclohexylmethyl)cyclopentan-1-ol
CID 10214864
1-Cyclopentyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol
CID 10236161
1-(Cyclohexylmethyl)-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-ol
CID 10286140
1-Cyclohexyl-2-(pyrrolidin-1-ylmethyl)cycloheptan-1-ol
CID 10308249
2-(Azepan-1-ylmethyl)-1-cyclopentylcyclopentan-1-ol
CID 68802245
2-(Azepan-1-ylmethyl)-1-cyclohexylcyclopentan-1-ol
CID 68802888
1-[1-Cyclopentyl-2-(dimethylamino)ethyl]cyclohexan-1-ol
CID 131991103
1,1-Dicyclohexyl-3-pyrrolidin-1-ylpropan-1-ol
CID 10357069
3-Cyclohexyl-1-methylpyrrolidin-3-ol
CID 62976346
3-(2-Ethylcyclohexyl)-1-methylpyrrolidin-3-ol
CID 63861632

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol?
The IUPAC name of 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol (CID 10286001) is 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol.
What is the SMILES notation for 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol?
The canonical SMILES for 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol is OC1(C2CCCCC2)CCCC1CN1CCCC1.
What is the InChIKey of 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol?
The InChIKey is KPUYVVPBOCNQIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO/c18-16(14-7-2-1-3-8-14)10-6-9-15(16)13-17-11-4-5-12-17/h14-15,18H,1-13H2.
What are the key properties of 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol?
1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol has a molecular weight of 251.41 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol is sourced from PubChem (CID 10286001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).