2-(aminomethyl)cyclopentan-1-ol

C6H13NO — CID 533887

IUPAC2-(aminomethyl)cyclopentan-1-ol
SMILESNCC1CCCC1O
InChIInChI=1S/C6H13NO/c7-4-5-2-1-3-6(5)8/h5-6,8H,1-4,7H2
InChIKeyVORALDSQPSWPRK-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.11
Rot. Bonds1

About 2-(aminomethyl)cyclopentan-1-ol

2-(aminomethyl)cyclopentan-1-ol (PubChem CID 533887) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 2-(aminomethyl)cyclopentan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)cyclopentan-1-ol
PubChem CID533887
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name2-(aminomethyl)cyclopentan-1-ol
SMILESNCC1CCCC1O
InChIInChI=1S/C6H13NO/c7-4-5-2-1-3-6(5)8/h5-6,8H,1-4,7H2
InChIKeyVORALDSQPSWPRK-UHFFFAOYSA-N
XLogP0.11
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)cyclopentan-1-ol?
The IUPAC name of 2-(aminomethyl)cyclopentan-1-ol (CID 533887) is 2-(aminomethyl)cyclopentan-1-ol.
What is the SMILES notation for 2-(aminomethyl)cyclopentan-1-ol?
The canonical SMILES for 2-(aminomethyl)cyclopentan-1-ol is NCC1CCCC1O.
What is the InChIKey of 2-(aminomethyl)cyclopentan-1-ol?
The InChIKey is VORALDSQPSWPRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c7-4-5-2-1-3-6(5)8/h5-6,8H,1-4,7H2.
What are the key properties of 2-(aminomethyl)cyclopentan-1-ol?
2-(aminomethyl)cyclopentan-1-ol has a molecular weight of 115.18 g/mol, XLogP of 0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)cyclopentan-1-ol is sourced from PubChem (CID 533887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).