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

C10H16ClN3OS — CID 119822723

IUPAC2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride
SMILESCl.Cn1ccs/c1=N/C(=O)C1CCCC1N
InChIInChI=1S/C10H15N3OS.ClH/c1-13-5-6-15-10(13)12-9(14)7-3-2-4-8(7)11;/h5-8H,2-4,11H2,1H3;1H/b12-10+;
InChIKeyBVNTXLQJKDIRKR-VHPXAQPISA-N
MW261.78 g/mol
LogP1.06
Rot. Bonds1

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

2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119822723) has the molecular formula C10H16ClN3OS and a molecular weight of 261.78 g/mol. Its IUPAC name is 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119822723
Molecular FormulaC10H16ClN3OS
Molecular Weight261.78 g/mol
Exact Mass261.07
IUPAC Name2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride
SMILESCl.Cn1ccs/c1=N/C(=O)C1CCCC1N
InChIInChI=1S/C10H15N3OS.ClH/c1-13-5-6-15-10(13)12-9(14)7-3-2-4-8(7)11;/h5-8H,2-4,11H2,1H3;1H/b12-10+;
InChIKeyBVNTXLQJKDIRKR-VHPXAQPISA-N
XLogP1.06
TPSA60.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.78
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride (CID 119822723) is 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride is Cl.Cn1ccs/c1=N/C(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is BVNTXLQJKDIRKR-VHPXAQPISA-N. The full InChI is InChI=1S/C10H15N3OS.ClH/c1-13-5-6-15-10(13)12-9(14)7-3-2-4-8(7)11;/h5-8H,2-4,11H2,1H3;1H/b12-10+;.
What are the key properties of 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride?
2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 261.78 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119822723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).