7-pyrrolidin-2-ylheptan-1-ol

C11H23NO — CID 10330055

IUPAC7-pyrrolidin-2-ylheptan-1-ol
SMILESOCCCCCCCC1CCCN1
InChIInChI=1S/C11H23NO/c13-10-5-3-1-2-4-7-11-8-6-9-12-11/h11-13H,1-10H2
InChIKeyDXEZNJABSFECSH-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.07
Rot. Bonds7

About 7-pyrrolidin-2-ylheptan-1-ol

7-pyrrolidin-2-ylheptan-1-ol (PubChem CID 10330055) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 7-pyrrolidin-2-ylheptan-1-ol.

Molecular Properties

Compound Name7-pyrrolidin-2-ylheptan-1-ol
PubChem CID10330055
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name7-pyrrolidin-2-ylheptan-1-ol
SMILESOCCCCCCCC1CCCN1
InChIInChI=1S/C11H23NO/c13-10-5-3-1-2-4-7-11-8-6-9-12-11/h11-13H,1-10H2
InChIKeyDXEZNJABSFECSH-UHFFFAOYSA-N
XLogP2.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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2-[(2S)-piperidin-2-yl]ethanol;hydrochloride
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CID 151771246
ethane;2-piperidin-2-ylethanol
CID 91203064
4-[(2S)-aziridin-2-yl]butan-1-ol
CID 99770578
2-heptadecylazepane
CID 4009189
5-pyrrolidin-2-ylpentanenitrile
CID 174696623
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Frequently Asked Questions

What is the IUPAC name of 7-pyrrolidin-2-ylheptan-1-ol?
The IUPAC name of 7-pyrrolidin-2-ylheptan-1-ol (CID 10330055) is 7-pyrrolidin-2-ylheptan-1-ol.
What is the SMILES notation for 7-pyrrolidin-2-ylheptan-1-ol?
The canonical SMILES for 7-pyrrolidin-2-ylheptan-1-ol is OCCCCCCCC1CCCN1.
What is the InChIKey of 7-pyrrolidin-2-ylheptan-1-ol?
The InChIKey is DXEZNJABSFECSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c13-10-5-3-1-2-4-7-11-8-6-9-12-11/h11-13H,1-10H2.
What are the key properties of 7-pyrrolidin-2-ylheptan-1-ol?
7-pyrrolidin-2-ylheptan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 2.07, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-pyrrolidin-2-ylheptan-1-ol is sourced from PubChem (CID 10330055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).