(4-aminocyclopent-2-en-1-yl)methanol

C6H11NO — CID 10313113

IUPAC(4-aminocyclopent-2-en-1-yl)methanol
SMILESNC1C=CC(CO)C1
InChIInChI=1S/C6H11NO/c7-6-2-1-5(3-6)4-8/h1-2,5-6,8H,3-4,7H2
InChIKeyUXKZFJDNFBNQHE-UHFFFAOYSA-N
MW113.16 g/mol
LogP-0.12
Rot. Bonds1

About (4-aminocyclopent-2-en-1-yl)methanol

(4-aminocyclopent-2-en-1-yl)methanol (PubChem CID 10313113) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (4-aminocyclopent-2-en-1-yl)methanol.

Molecular Properties

Compound Name(4-aminocyclopent-2-en-1-yl)methanol
PubChem CID10313113
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(4-aminocyclopent-2-en-1-yl)methanol
SMILESNC1C=CC(CO)C1
InChIInChI=1S/C6H11NO/c7-6-2-1-5(3-6)4-8/h1-2,5-6,8H,3-4,7H2
InChIKeyUXKZFJDNFBNQHE-UHFFFAOYSA-N
XLogP-0.12
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(1R,4S)-4-Aminocyclopent-2-en-1-yl]methanol
CID 9934457
((1R,4S)-4-aminocyclopent-2-en-1-yl)methanol hydrochloride
CID 12899914
(1S,4R)-4-amino-2-cyclopentene-1-methanol
CID 9793729
2-Cyclopentene-1-methanol, 4-amino-, hydrochloride (1:1), (1S,4R)-
CID 53471860
[4-(Aminomethyl)cyclopent-2-en-1-yl]methanol
CID 85412251
[(1R,2S)-2-aminocyclopent-3-en-1-yl]methanol
CID 12081657
[(1S,4R)-4-amino-2-methylcyclopent-2-en-1-yl]methanol
CID 55285248
(2-Aminocyclopent-3-en-1-yl)methanol
CID 85433880
[(1S,4R)-4-amino-3-fluorocyclopent-2-en-1-yl]methanol
CID 55284741
[(1S,4R)-4-(aminomethyl)cyclopent-2-en-1-yl]methanol
CID 11137176
Rel-((1S,6S)-6-aminocyclohex-3-en-1-yl)methanol
CID 7157088
((1S,4S)-4-Aminocyclopent-2-en-1-yl)methanol
CID 9793730

Frequently Asked Questions

What is the IUPAC name of (4-aminocyclopent-2-en-1-yl)methanol?
The IUPAC name of (4-aminocyclopent-2-en-1-yl)methanol (CID 10313113) is (4-aminocyclopent-2-en-1-yl)methanol.
What is the SMILES notation for (4-aminocyclopent-2-en-1-yl)methanol?
The canonical SMILES for (4-aminocyclopent-2-en-1-yl)methanol is NC1C=CC(CO)C1.
What is the InChIKey of (4-aminocyclopent-2-en-1-yl)methanol?
The InChIKey is UXKZFJDNFBNQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c7-6-2-1-5(3-6)4-8/h1-2,5-6,8H,3-4,7H2.
What are the key properties of (4-aminocyclopent-2-en-1-yl)methanol?
(4-aminocyclopent-2-en-1-yl)methanol has a molecular weight of 113.16 g/mol, XLogP of -0.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminocyclopent-2-en-1-yl)methanol is sourced from PubChem (CID 10313113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).