1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol

C5H10N2S — CID 89275390

IUPAC1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol
SMILESC=C(S)N/C(C)=C\N
InChIInChI=1S/C5H10N2S/c1-4(3-6)7-5(2)8/h3,7-8H,2,6H2,1H3/b4-3-
InChIKeyJSFVOUMDVBDPBP-ARJAWSKDSA-N
MW130.22 g/mol
LogP0.80
Rot. Bonds2

About 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol

1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol (PubChem CID 89275390) has the molecular formula C5H10N2S and a molecular weight of 130.22 g/mol. Its IUPAC name is 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol.

Molecular Properties

Compound Name1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol
PubChem CID89275390
Molecular FormulaC5H10N2S
Molecular Weight130.22 g/mol
Exact Mass130.06
IUPAC Name1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol
SMILESC=C(S)N/C(C)=C\N
InChIInChI=1S/C5H10N2S/c1-4(3-6)7-5(2)8/h3,7-8H,2,6H2,1H3/b4-3-
InChIKeyJSFVOUMDVBDPBP-ARJAWSKDSA-N
XLogP0.80
TPSA38.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.22
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(Z)-2-N-(1-aminoethenyl)prop-1-ene-1,2-diamine
CID 146561035
3-methyl-N-(1-sulfanylethenyl)but-2-enamide
CID 89009191
(Z)-2-hydrazinylprop-1-en-1-amine;molecular hydrogen
CID 144561883
ethane;1-methoxyethenamine;2-methylprop-1-en-1-amine
CID 168977027
(Z)-N-prop-1-en-2-ylbut-2-en-2-amine
CID 142199904
bis(carbamodithioic acid);2-methylprop-1-ene
CID 88714741
2-methylbut-2-ene;prop-1-ene-2-thiol
CID 156752035
ethane;(Z)-2-(methylideneamino)prop-1-en-1-amine
CID 142804445
N-[(1E,3Z)-1-amino-5-methylhexa-1,3,5-trien-2-yl]acetamide
CID 89013106
1-[[(3E,5Z)-6-amino-5-chloro-2-[(2,6-difluorophenyl)methylimino]hexa-3,5-dien-3-yl]amino]ethenethiol
CID 130391567
(3E)-penta-1,3-diene-2,4-diol
CID 21340298
(1E,3Z)-2,3-dimethylbuta-1,3-diene-1,4-diamine
CID 167286267

Frequently Asked Questions

What is the IUPAC name of 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol?
The IUPAC name of 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol (CID 89275390) is 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol.
What is the SMILES notation for 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol?
The canonical SMILES for 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol is C=C(S)N/C(C)=C\N.
What is the InChIKey of 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol?
The InChIKey is JSFVOUMDVBDPBP-ARJAWSKDSA-N. The full InChI is InChI=1S/C5H10N2S/c1-4(3-6)7-5(2)8/h3,7-8H,2,6H2,1H3/b4-3-.
What are the key properties of 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol?
1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol has a molecular weight of 130.22 g/mol, XLogP of 0.80, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(Z)-1-aminoprop-1-en-2-yl]amino]ethenethiol is sourced from PubChem (CID 89275390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).