2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide

C10H10N4OS — CID 166871884

IUPAC2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide
SMILESNc1cnc(NC(=O)c2ccccc2N)s1
InChIInChI=1S/C10H10N4OS/c11-7-4-2-1-3-6(7)9(15)14-10-13-5-8(12)16-10/h1-5H,11-12H2,(H,13,14,15)
InChIKeyJZHAAIBBFVMFAW-UHFFFAOYSA-N
MW234.28 g/mol
LogP1.56
Rot. Bonds2

About 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide

2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide (PubChem CID 166871884) has the molecular formula C10H10N4OS and a molecular weight of 234.28 g/mol. Its IUPAC name is 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide
PubChem CID166871884
Molecular FormulaC10H10N4OS
Molecular Weight234.28 g/mol
Exact Mass234.06
IUPAC Name2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide
SMILESNc1cnc(NC(=O)c2ccccc2N)s1
InChIInChI=1S/C10H10N4OS/c11-7-4-2-1-3-6(7)9(15)14-10-13-5-8(12)16-10/h1-5H,11-12H2,(H,13,14,15)
InChIKeyJZHAAIBBFVMFAW-UHFFFAOYSA-N
XLogP1.56
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[2-[(5-amino-1,3-thiazol-2-yl)carbamoyl]phenyl] 2-methylpropyl carbonate
CID 146916166
2-amino-N-(1,3-benzothiazol-2-yl)benzamide
CID 828314
2-amino-N-(5-bromo-2-pyridinyl)benzamide
CID 13348356
N-(5-bromo-1,3-thiazol-2-yl)-2-fluorobenzamide
CID 60654750
N-(5-bromo-1,3-thiazol-2-yl)-2-(trifluoromethyl)benzamide
CID 60654812
2-amino-N-pyrimidin-5-ylbenzamide
CID 107587397
[2-[(5-amino-1,3-thiazol-2-yl)carbamoyl]-6-(butanoylamino)phenyl] butanoate
CID 166873078
3-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-methylbenzamide
CID 61471793
2-amino-N-pyridin-4-ylbenzamide
CID 5080262
N-(5-methyl-1,3-thiazol-2-yl)-2-(trifluoromethyl)benzamide
CID 4813517
2-bromo-N-(5-cyano-1,3-thiazol-2-yl)benzamide
CID 90603571
5-amino-2,4-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 102704840

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide (CID 166871884) is 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide is Nc1cnc(NC(=O)c2ccccc2N)s1.
What is the InChIKey of 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide?
The InChIKey is JZHAAIBBFVMFAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4OS/c11-7-4-2-1-3-6(7)9(15)14-10-13-5-8(12)16-10/h1-5H,11-12H2,(H,13,14,15).
What are the key properties of 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide?
2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide has a molecular weight of 234.28 g/mol, XLogP of 1.56, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-amino-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 166871884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).