5-aminopent-3-en-2-ol

C5H11NO — CID 90709459

IUPAC5-aminopent-3-en-2-ol
SMILESCC(O)C=CCN
InChIInChI=1S/C5H11NO/c1-5(7)3-2-4-6/h2-3,5,7H,4,6H2,1H3
InChIKeyGRSNBZWNZMOQON-UHFFFAOYSA-N
MW101.15 g/mol
LogP-0.12
Rot. Bonds2

About 5-aminopent-3-en-2-ol

5-aminopent-3-en-2-ol (PubChem CID 90709459) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is 5-aminopent-3-en-2-ol.

Molecular Properties

Compound Name5-aminopent-3-en-2-ol
PubChem CID90709459
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name5-aminopent-3-en-2-ol
SMILESCC(O)C=CCN
InChIInChI=1S/C5H11NO/c1-5(7)3-2-4-6/h2-3,5,7H,4,6H2,1H3
InChIKeyGRSNBZWNZMOQON-UHFFFAOYSA-N
XLogP-0.12
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
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

4-methylpent-2-ene-1,5-diamine
CID 154632735
4,5-dimethylhexa-2,5-dien-1-amine
CID 175574520
(Z,2R)-6-aminohex-4-en-2-ol
CID 164590352
(E)-5-(dimethylamino)pent-3-en-2-ol
CID 130122470
octa-3,5-dien-2-ol
CID 543636
aminomethyl-dihydroxy-methylphosphanium
CID 6395030
(Z,2R)-non-3-en-2-ol
CID 11040800
(4S)-4-propan-2-ylhexa-2,5-dien-1-amine
CID 90743426
2-methylhept-4-en-3-ol
CID 54499499
(E,3R)-2-methylhept-4-en-3-ol
CID 59911150
hept-4-ene-2,3-diol
CID 54484674
undec-3-en-2-ol
CID 174515693

Frequently Asked Questions

What is the IUPAC name of 5-aminopent-3-en-2-ol?
The IUPAC name of 5-aminopent-3-en-2-ol (CID 90709459) is 5-aminopent-3-en-2-ol.
What is the SMILES notation for 5-aminopent-3-en-2-ol?
The canonical SMILES for 5-aminopent-3-en-2-ol is CC(O)C=CCN.
What is the InChIKey of 5-aminopent-3-en-2-ol?
The InChIKey is GRSNBZWNZMOQON-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-5(7)3-2-4-6/h2-3,5,7H,4,6H2,1H3.
What are the key properties of 5-aminopent-3-en-2-ol?
5-aminopent-3-en-2-ol has a molecular weight of 101.15 g/mol, XLogP of -0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-aminopent-3-en-2-ol is sourced from PubChem (CID 90709459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).