N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine

C3H7N2PS — CID 90783216

IUPACN-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESPNC1=NCCS1
InChIInChI=1S/C3H7N2PS/c6-5-3-4-1-2-7-3/h1-2,6H2,(H,4,5)
InChIKeyLAHBRTQANOKQFG-UHFFFAOYSA-N
MW134.14 g/mol
LogP0.47
Rot. Bonds

About N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine

N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 90783216) has the molecular formula C3H7N2PS and a molecular weight of 134.14 g/mol. Its IUPAC name is N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID90783216
Molecular FormulaC3H7N2PS
Molecular Weight134.14 g/mol
Exact Mass134.01
IUPAC NameN-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESPNC1=NCCS1
InChIInChI=1S/C3H7N2PS/c6-5-3-4-1-2-7-3/h1-2,6H2,(H,4,5)
InChIKeyLAHBRTQANOKQFG-UHFFFAOYSA-N
XLogP0.47
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4,5-Dihydro-2-thiazolamine
CID 15689
2-Amino-2-thiazoline hydrochloride
CID 520926
2-Iminothiazolidine hydrobromide
CID 197916
Diaminothiazoline
CID 53892820
5-Fluoro-4,5-dihydro-1,3-thiazol-2-amine
CID 147210442
N-thiophosphoroso-4,5-dihydro-1,3-thiazol-2-amine
CID 123614366
2-Amino thiazoline chloride
CID 43822546
N-chloro-4,5-dihydro-1,3-thiazol-2-amine
CID 126711063
4,5-Dihydro-1,3-thiazol-2-amine;molecular hydrogen
CID 143157221
N-(4,5-dihydro-1,3-thiazol-2-yl)thiohydroxylamine
CID 146475647
Azane;4,5-dihydro-1,3-thiazol-2-amine;hydrochloride
CID 174824845
4,5-Dihydro-1,3-thiazol-2-amine bromide
CID 49952067

Frequently Asked Questions

What is the IUPAC name of N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine (CID 90783216) is N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine is PNC1=NCCS1.
What is the InChIKey of N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is LAHBRTQANOKQFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N2PS/c6-5-3-4-1-2-7-3/h1-2,6H2,(H,4,5).
What are the key properties of N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine?
N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 134.14 g/mol, XLogP of 0.47, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phosphanyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 90783216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).