N-amino-N'-methylthiadiazole-5-carboximidamide

C4H7N5S — CID 65214944

IUPACN-amino-N'-methylthiadiazole-5-carboximidamide
SMILESC/N=C(\NN)c1cnns1
InChIInChI=1S/C4H7N5S/c1-6-4(8-5)3-2-7-9-10-3/h2H,5H2,1H3,(H,6,8)
InChIKeyGWCHGKDZWHWDMU-UHFFFAOYSA-N
MW157.20 g/mol
LogP-0.62
Rot. Bonds1

About N-amino-N'-methylthiadiazole-5-carboximidamide

N-amino-N'-methylthiadiazole-5-carboximidamide (PubChem CID 65214944) has the molecular formula C4H7N5S and a molecular weight of 157.20 g/mol. Its IUPAC name is N-amino-N'-methylthiadiazole-5-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-methylthiadiazole-5-carboximidamide
PubChem CID65214944
Molecular FormulaC4H7N5S
Molecular Weight157.20 g/mol
Exact Mass157.04
IUPAC NameN-amino-N'-methylthiadiazole-5-carboximidamide
SMILESC/N=C(\NN)c1cnns1
InChIInChI=1S/C4H7N5S/c1-6-4(8-5)3-2-7-9-10-3/h2H,5H2,1H3,(H,6,8)
InChIKeyGWCHGKDZWHWDMU-UHFFFAOYSA-N
XLogP-0.62
TPSA76.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.20
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Thiadiazole-5-carboximidamide
CID 20530866
Thiadiazole-5-carboximidamide;hydrochloride
CID 140336576
Azane;thiadiazole-5-carboximidamide
CID 174818360
N-amino-N'-ethylthiadiazole-5-carboximidamide
CID 65214945
N-amino-N'-propylthiadiazole-5-carboximidamide
CID 65214946
N-amino-N'-propan-2-ylthiadiazole-5-carboximidamide
CID 65214947
N-amino-N'-cyclopropylthiadiazole-5-carboximidamide
CID 65215001
N-amino-N'-tert-butylthiadiazole-5-carboximidamide
CID 65215002
N-amino-N'-cyclopentylthiadiazole-5-carboximidamide
CID 65215003
N-amino-N'-cyclohexylthiadiazole-5-carboximidamide
CID 65215004
N-amino-N'-(2-methoxyethyl)thiadiazole-5-carboximidamide
CID 65215060
N'-aminothiadiazole-5-carboximidamide
CID 77060408

Frequently Asked Questions

What is the IUPAC name of N-amino-N'-methylthiadiazole-5-carboximidamide?
The IUPAC name of N-amino-N'-methylthiadiazole-5-carboximidamide (CID 65214944) is N-amino-N'-methylthiadiazole-5-carboximidamide.
What is the SMILES notation for N-amino-N'-methylthiadiazole-5-carboximidamide?
The canonical SMILES for N-amino-N'-methylthiadiazole-5-carboximidamide is C/N=C(\NN)c1cnns1.
What is the InChIKey of N-amino-N'-methylthiadiazole-5-carboximidamide?
The InChIKey is GWCHGKDZWHWDMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N5S/c1-6-4(8-5)3-2-7-9-10-3/h2H,5H2,1H3,(H,6,8).
What are the key properties of N-amino-N'-methylthiadiazole-5-carboximidamide?
N-amino-N'-methylthiadiazole-5-carboximidamide has a molecular weight of 157.20 g/mol, XLogP of -0.62, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-methylthiadiazole-5-carboximidamide is sourced from PubChem (CID 65214944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).