(Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol

C5H9NS — CID 89468774

IUPAC(Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol
SMILESC/C=C\N/C=C\S
InChIInChI=1S/C5H9NS/c1-2-3-6-4-5-7/h2-7H,1H3/b3-2-,5-4-
InChIKeyNVFDFYNTSHYCQD-LDIADDGTSA-N
MW115.20 g/mol
LogP1.51
Rot. Bonds2

About (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol

(Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol (PubChem CID 89468774) has the molecular formula C5H9NS and a molecular weight of 115.20 g/mol. Its IUPAC name is (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol.

Molecular Properties

Compound Name(Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol
PubChem CID89468774
Molecular FormulaC5H9NS
Molecular Weight115.20 g/mol
Exact Mass115.05
IUPAC Name(Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol
SMILESC/C=C\N/C=C\S
InChIInChI=1S/C5H9NS/c1-2-3-6-4-5-7/h2-7H,1H3/b3-2-,5-4-
InChIKeyNVFDFYNTSHYCQD-LDIADDGTSA-N
XLogP1.51
TPSA12.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.20
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol?
The IUPAC name of (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol (CID 89468774) is (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol.
What is the SMILES notation for (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol?
The canonical SMILES for (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol is C/C=C\N/C=C\S.
What is the InChIKey of (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol?
The InChIKey is NVFDFYNTSHYCQD-LDIADDGTSA-N. The full InChI is InChI=1S/C5H9NS/c1-2-3-6-4-5-7/h2-7H,1H3/b3-2-,5-4-.
What are the key properties of (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol?
(Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol has a molecular weight of 115.20 g/mol, XLogP of 1.51, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-[[(Z)-prop-1-enyl]amino]ethenethiol is sourced from PubChem (CID 89468774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).