(Z)-1-amino-2-phosphanylprop-1-ene-1-thiol

C3H8NPS — CID 135189673

IUPAC(Z)-1-amino-2-phosphanylprop-1-ene-1-thiol
SMILESC/C(P)=C(\N)S
InChIInChI=1S/C3H8NPS/c1-2(5)3(4)6/h6H,4-5H2,1H3/b3-2-
InChIKeyZRGMQVLEUKATMU-IHWYPQMZSA-N
MW121.15 g/mol
LogP0.94
Rot. Bonds

About (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol

(Z)-1-amino-2-phosphanylprop-1-ene-1-thiol (PubChem CID 135189673) has the molecular formula C3H8NPS and a molecular weight of 121.15 g/mol. Its IUPAC name is (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol.

Molecular Properties

Compound Name(Z)-1-amino-2-phosphanylprop-1-ene-1-thiol
PubChem CID135189673
Molecular FormulaC3H8NPS
Molecular Weight121.15 g/mol
Exact Mass121.01
IUPAC Name(Z)-1-amino-2-phosphanylprop-1-ene-1-thiol
SMILESC/C(P)=C(\N)S
InChIInChI=1S/C3H8NPS/c1-2(5)3(4)6/h6H,4-5H2,1H3/b3-2-
InChIKeyZRGMQVLEUKATMU-IHWYPQMZSA-N
XLogP0.94
TPSA26.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.15
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-1,2-diaminoprop-1-ene-1-thiol
CID 143171578
3-amino-1-phosphanyl-2-sulfanylbut-2-en-1-one
CID 163919529
acetamide;carbamothioic S-acid
CID 160740835
bis(carbamodithioic acid);2-methylprop-1-ene
CID 88714741
azane;carbamothioic S-acid
CID 12743068
bis(carbamothioic S-acid);methanethiol
CID 173288560
(2Z,4Z)-2-phosphanylhepta-2,4,6-trien-3-amine
CID 139493202
(2Z)-3,4-diaminopenta-2,4-diene-2-thiol
CID 147166745
acetamide
CID 139024037
carbamodithioic acid;selane
CID 174428895
prop-1-ene-1,1,2-trithiol
CID 88897307
carbamodithioic acid;carbonotrithioic acid
CID 88693688

Frequently Asked Questions

What is the IUPAC name of (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol?
The IUPAC name of (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol (CID 135189673) is (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol.
What is the SMILES notation for (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol?
The canonical SMILES for (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol is C/C(P)=C(\N)S.
What is the InChIKey of (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol?
The InChIKey is ZRGMQVLEUKATMU-IHWYPQMZSA-N. The full InChI is InChI=1S/C3H8NPS/c1-2(5)3(4)6/h6H,4-5H2,1H3/b3-2-.
What are the key properties of (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol?
(Z)-1-amino-2-phosphanylprop-1-ene-1-thiol has a molecular weight of 121.15 g/mol, XLogP of 0.94, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-amino-2-phosphanylprop-1-ene-1-thiol is sourced from PubChem (CID 135189673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).