[(Z)-prop-1-enyl]sulfanylmethanamine

C4H9NS — CID 143909807

IUPAC[(Z)-prop-1-enyl]sulfanylmethanamine
SMILESC/C=C\SCN
InChIInChI=1S/C4H9NS/c1-2-3-6-4-5/h2-3H,4-5H2,1H3/b3-2-
InChIKeyMQXIKANIUPSBHE-IHWYPQMZSA-N
MW103.19 g/mol
LogP1.17
Rot. Bonds2

About [(Z)-prop-1-enyl]sulfanylmethanamine

[(Z)-prop-1-enyl]sulfanylmethanamine (PubChem CID 143909807) has the molecular formula C4H9NS and a molecular weight of 103.19 g/mol. Its IUPAC name is [(Z)-prop-1-enyl]sulfanylmethanamine.

Molecular Properties

Compound Name[(Z)-prop-1-enyl]sulfanylmethanamine
PubChem CID143909807
Molecular FormulaC4H9NS
Molecular Weight103.19 g/mol
Exact Mass103.05
IUPAC Name[(Z)-prop-1-enyl]sulfanylmethanamine
SMILESC/C=C\SCN
InChIInChI=1S/C4H9NS/c1-2-3-6-4-5/h2-3H,4-5H2,1H3/b3-2-
InChIKeyMQXIKANIUPSBHE-IHWYPQMZSA-N
XLogP1.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.19
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-[(E)-prop-1-enyl]sulfanylpropane
CID 5366861
ethane;ethene;(Z)-1-ethylsulfanylprop-1-ene
CID 143200464
1-[(Z)-prop-1-enyl]sulfanylbutane
CID 21160112
1-(2-methoxyethylsulfanyl)prop-1-ene
CID 71371886
[(Z)-2-cyclopropylethenyl]sulfanylmethanamine
CID 166649262
1-[(Z)-prop-1-enyl]sulfanylpentane
CID 143331844
(Z)-1-[(Z)-2-[(E)-prop-1-enyl]sulfanylethenyl]sulfanylprop-1-ene
CID 131846011
1-(2-chloroethylsulfanyl)-3-[(E)-prop-1-enyl]sulfanylpropane
CID 101106688
ethene;[(Z)-prop-1-enyl]sulfanylmethylcyclohexane
CID 176708755
[(E)-prop-1-enyl] thiohypoiodite
CID 21017925
(E)-1-[[(E)-prop-1-enyl]trisulfanyl]prop-1-ene
CID 5352793
ethane;1-methylsulfanylprop-1-ene
CID 91807645

Frequently Asked Questions

What is the IUPAC name of [(Z)-prop-1-enyl]sulfanylmethanamine?
The IUPAC name of [(Z)-prop-1-enyl]sulfanylmethanamine (CID 143909807) is [(Z)-prop-1-enyl]sulfanylmethanamine.
What is the SMILES notation for [(Z)-prop-1-enyl]sulfanylmethanamine?
The canonical SMILES for [(Z)-prop-1-enyl]sulfanylmethanamine is C/C=C\SCN.
What is the InChIKey of [(Z)-prop-1-enyl]sulfanylmethanamine?
The InChIKey is MQXIKANIUPSBHE-IHWYPQMZSA-N. The full InChI is InChI=1S/C4H9NS/c1-2-3-6-4-5/h2-3H,4-5H2,1H3/b3-2-.
What are the key properties of [(Z)-prop-1-enyl]sulfanylmethanamine?
[(Z)-prop-1-enyl]sulfanylmethanamine has a molecular weight of 103.19 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-prop-1-enyl]sulfanylmethanamine is sourced from PubChem (CID 143909807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).