5-[cyclopropyl(propyl)amino]pentan-1-ol

C11H23NO — CID 62227850

IUPAC5-[cyclopropyl(propyl)amino]pentan-1-ol
SMILESCCCN(CCCCCO)C1CC1
InChIInChI=1S/C11H23NO/c1-2-8-12(11-6-7-11)9-4-3-5-10-13/h11,13H,2-10H2,1H3
InChIKeyXMFGYSXZKZDETK-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.02
Rot. Bonds8

About 5-[cyclopropyl(propyl)amino]pentan-1-ol

5-[cyclopropyl(propyl)amino]pentan-1-ol (PubChem CID 62227850) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 5-[cyclopropyl(propyl)amino]pentan-1-ol.

Molecular Properties

Compound Name5-[cyclopropyl(propyl)amino]pentan-1-ol
PubChem CID62227850
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name5-[cyclopropyl(propyl)amino]pentan-1-ol
SMILESCCCN(CCCCCO)C1CC1
InChIInChI=1S/C11H23NO/c1-2-8-12(11-6-7-11)9-4-3-5-10-13/h11,13H,2-10H2,1H3
InChIKeyXMFGYSXZKZDETK-UHFFFAOYSA-N
XLogP2.02
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[cyclopropyl(propyl)amino]pentan-1-ol?
The IUPAC name of 5-[cyclopropyl(propyl)amino]pentan-1-ol (CID 62227850) is 5-[cyclopropyl(propyl)amino]pentan-1-ol.
What is the SMILES notation for 5-[cyclopropyl(propyl)amino]pentan-1-ol?
The canonical SMILES for 5-[cyclopropyl(propyl)amino]pentan-1-ol is CCCN(CCCCCO)C1CC1.
What is the InChIKey of 5-[cyclopropyl(propyl)amino]pentan-1-ol?
The InChIKey is XMFGYSXZKZDETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-2-8-12(11-6-7-11)9-4-3-5-10-13/h11,13H,2-10H2,1H3.
What are the key properties of 5-[cyclopropyl(propyl)amino]pentan-1-ol?
5-[cyclopropyl(propyl)amino]pentan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 2.02, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopropyl(propyl)amino]pentan-1-ol is sourced from PubChem (CID 62227850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).