1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol

C17H31NO — CID 107008624

IUPAC1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol
SMILESC=CCCCCCC(O)C1(N2CCCC2)CCCC1
InChIInChI=1S/C17H31NO/c1-2-3-4-5-6-11-16(19)17(12-7-8-13-17)18-14-9-10-15-18/h2,16,19H,1,3-15H2
InChIKeyDOHTXTFDARGAMN-UHFFFAOYSA-N
MW265.44 g/mol
LogP3.89
Rot. Bonds8

About 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol

1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol (PubChem CID 107008624) has the molecular formula C17H31NO and a molecular weight of 265.44 g/mol. Its IUPAC name is 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol.

Molecular Properties

Compound Name1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol
PubChem CID107008624
Molecular FormulaC17H31NO
Molecular Weight265.44 g/mol
Exact Mass265.24
IUPAC Name1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol
SMILESC=CCCCCCC(O)C1(N2CCCC2)CCCC1
InChIInChI=1S/C17H31NO/c1-2-3-4-5-6-11-16(19)17(12-7-8-13-17)18-14-9-10-15-18/h2,16,19H,1,3-15H2
InChIKeyDOHTXTFDARGAMN-UHFFFAOYSA-N
XLogP3.89
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(3R)-5-but-3-enyl-1-tert-butyl-5-methylpyrrolidin-3-ol
CID 175062457
2-Methyl-2-pyrrolidin-1-yloct-7-en-3-ol
CID 79056533
1-(1-Piperidin-1-ylcyclopentyl)but-3-en-1-ol
CID 79057985
1-(1-Piperidin-1-ylcyclopentyl)pent-4-en-1-ol
CID 79058242
1-(1-Pyrrolidin-1-ylcyclopentyl)hex-5-en-1-ol
CID 79058445
1-(1-Piperidin-1-ylcyclopentyl)hex-5-en-1-ol
CID 79059757
1-(1-Pyrrolidin-1-ylcyclopentyl)but-3-en-1-ol
CID 79060151
1-(1-Pyrrolidin-1-ylcyclopentyl)pent-4-en-1-ol
CID 79060162
3-Methylidene-1-(1-pyrrolidin-1-ylcyclopentyl)pentan-1-ol
CID 79060164
3-(Diethylamino)-3-ethylnon-8-en-4-ol
CID 79061533
3-(Diethylamino)-3-methylnon-8-en-4-ol
CID 79063059
1-[1-(Dimethylamino)cyclopentyl]hex-5-en-1-ol
CID 79067152

Frequently Asked Questions

What is the IUPAC name of 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol?
The IUPAC name of 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol (CID 107008624) is 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol.
What is the SMILES notation for 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol?
The canonical SMILES for 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol is C=CCCCCCC(O)C1(N2CCCC2)CCCC1.
What is the InChIKey of 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol?
The InChIKey is DOHTXTFDARGAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NO/c1-2-3-4-5-6-11-16(19)17(12-7-8-13-17)18-14-9-10-15-18/h2,16,19H,1,3-15H2.
What are the key properties of 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol?
1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol has a molecular weight of 265.44 g/mol, XLogP of 3.89, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-pyrrolidin-1-ylcyclopentyl)oct-7-en-1-ol is sourced from PubChem (CID 107008624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).