1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol

C11H23NO2 — CID 65111515

IUPAC1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol
SMILESOCCCCCNCC1(O)CCCC1
InChIInChI=1S/C11H23NO2/c13-9-5-1-4-8-12-10-11(14)6-2-3-7-11/h12-14H,1-10H2
InChIKeyQQXAENBNVOJHCR-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.04
Rot. Bonds7

About 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol

1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol (PubChem CID 65111515) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol
PubChem CID65111515
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol
SMILESOCCCCCNCC1(O)CCCC1
InChIInChI=1S/C11H23NO2/c13-9-5-1-4-8-12-10-11(14)6-2-3-7-11/h12-14H,1-10H2
InChIKeyQQXAENBNVOJHCR-UHFFFAOYSA-N
XLogP1.04
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol (CID 65111515) is 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol is OCCCCCNCC1(O)CCCC1.
What is the InChIKey of 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol?
The InChIKey is QQXAENBNVOJHCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c13-9-5-1-4-8-12-10-11(14)6-2-3-7-11/h12-14H,1-10H2.
What are the key properties of 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol?
1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.04, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-hydroxypentylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 65111515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).