1-[2-(ethylamino)ethyl]cyclopentan-1-ol

C9H19NO — CID 121358963

IUPAC1-[2-(ethylamino)ethyl]cyclopentan-1-ol
SMILESCCNCCC1(O)CCCC1
InChIInChI=1S/C9H19NO/c1-2-10-8-7-9(11)5-3-4-6-9/h10-11H,2-8H2,1H3
InChIKeyBRBJVYRWNITISS-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.29
Rot. Bonds4

About 1-[2-(ethylamino)ethyl]cyclopentan-1-ol

1-[2-(ethylamino)ethyl]cyclopentan-1-ol (PubChem CID 121358963) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-[2-(ethylamino)ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[2-(ethylamino)ethyl]cyclopentan-1-ol
PubChem CID121358963
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name1-[2-(ethylamino)ethyl]cyclopentan-1-ol
SMILESCCNCCC1(O)CCCC1
InChIInChI=1S/C9H19NO/c1-2-10-8-7-9(11)5-3-4-6-9/h10-11H,2-8H2,1H3
InChIKeyBRBJVYRWNITISS-UHFFFAOYSA-N
XLogP1.29
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.29
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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Frequently Asked Questions

What is the IUPAC name of 1-[2-(ethylamino)ethyl]cyclopentan-1-ol?
The IUPAC name of 1-[2-(ethylamino)ethyl]cyclopentan-1-ol (CID 121358963) is 1-[2-(ethylamino)ethyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[2-(ethylamino)ethyl]cyclopentan-1-ol?
The canonical SMILES for 1-[2-(ethylamino)ethyl]cyclopentan-1-ol is CCNCCC1(O)CCCC1.
What is the InChIKey of 1-[2-(ethylamino)ethyl]cyclopentan-1-ol?
The InChIKey is BRBJVYRWNITISS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-2-10-8-7-9(11)5-3-4-6-9/h10-11H,2-8H2,1H3.
What are the key properties of 1-[2-(ethylamino)ethyl]cyclopentan-1-ol?
1-[2-(ethylamino)ethyl]cyclopentan-1-ol has a molecular weight of 157.26 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(ethylamino)ethyl]cyclopentan-1-ol is sourced from PubChem (CID 121358963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).