1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride

C11H18ClN3OS — CID 119345930

IUPAC1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride
SMILESCl.Cn1ccs/c1=N/C(=O)C1(N)CCCCC1
InChIInChI=1S/C11H17N3OS.ClH/c1-14-7-8-16-10(14)13-9(15)11(12)5-3-2-4-6-11;/h7-8H,2-6,12H2,1H3;1H/b13-10+;
InChIKeyPZZKIPSJIXODFM-RSGUCCNWSA-N
MW275.80 g/mol
LogP1.60
Rot. Bonds1

About 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride

1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119345930) has the molecular formula C11H18ClN3OS and a molecular weight of 275.80 g/mol. Its IUPAC name is 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride
PubChem CID119345930
Molecular FormulaC11H18ClN3OS
Molecular Weight275.80 g/mol
Exact Mass275.09
IUPAC Name1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride
SMILESCl.Cn1ccs/c1=N/C(=O)C1(N)CCCCC1
InChIInChI=1S/C11H17N3OS.ClH/c1-14-7-8-16-10(14)13-9(15)11(12)5-3-2-4-6-11;/h7-8H,2-6,12H2,1H3;1H/b13-10+;
InChIKeyPZZKIPSJIXODFM-RSGUCCNWSA-N
XLogP1.60
TPSA60.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.80
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride (CID 119345930) is 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride is Cl.Cn1ccs/c1=N/C(=O)C1(N)CCCCC1.
What is the InChIKey of 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is PZZKIPSJIXODFM-RSGUCCNWSA-N. The full InChI is InChI=1S/C11H17N3OS.ClH/c1-14-7-8-16-10(14)13-9(15)11(12)5-3-2-4-6-11;/h7-8H,2-6,12H2,1H3;1H/b13-10+;.
What are the key properties of 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride?
1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 275.80 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119345930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).