N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride

C9H15ClN4OS — CID 119566537

IUPACN-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride
SMILESCl.NCC1(NC(=O)c2cnsn2)CCCC1
InChIInChI=1S/C9H14N4OS.ClH/c10-6-9(3-1-2-4-9)12-8(14)7-5-11-15-13-7;/h5H,1-4,6,10H2,(H,12,14);1H
InChIKeyAWNNSALXCBTAHR-UHFFFAOYSA-N
MW262.77 g/mol
LogP0.96
Rot. Bonds3

About N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride

N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride (PubChem CID 119566537) has the molecular formula C9H15ClN4OS and a molecular weight of 262.77 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride
PubChem CID119566537
Molecular FormulaC9H15ClN4OS
Molecular Weight262.77 g/mol
Exact Mass262.07
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride
SMILESCl.NCC1(NC(=O)c2cnsn2)CCCC1
InChIInChI=1S/C9H14N4OS.ClH/c10-6-9(3-1-2-4-9)12-8(14)7-5-11-15-13-7;/h5H,1-4,6,10H2,(H,12,14);1H
InChIKeyAWNNSALXCBTAHR-UHFFFAOYSA-N
XLogP0.96
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.77
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(aminomethyl)-2-methylcyclohexyl]-1,2,5-thiadiazole-3-carboxamide
CID 113283690
N-[1-(aminomethyl)cyclopentyl]-2H-triazole-4-carboxamide
CID 63888380
N-[1-(aminomethyl)cyclopentyl]-5-chloropyridine-2-carboxamide;dihydrochloride
CID 119566570
N-[1-(aminomethyl)cyclopentyl]-4-fluorobenzamide;hydrochloride
CID 119567161
4-acetyl-N-[1-(aminomethyl)cyclopentyl]benzamide;hydrochloride
CID 119564862
N-[[1-(hydroxymethyl)cyclohexyl]methyl]-1,2,5-thiadiazole-3-carboxamide
CID 112699813
N-[1-(aminomethyl)cyclopentyl]-4-fluorobenzamide
CID 63753788
N-[1-(aminomethyl)cyclopentyl]-5-(methoxymethyl)-1,2-oxazole-3-carboxamide;hydrochloride
CID 119566646
N-[1-(aminomethyl)cyclopentyl]-4-methoxybenzamide;hydrochloride
CID 119566284
N-[1-(aminomethyl)cyclohexyl]-4-tert-butylbenzamide
CID 63754595
N-[1-(aminomethyl)cyclopentyl]-6-methylpyridine-3-carboxamide
CID 63753423
N-[1-(aminomethyl)cyclopentyl]-1-phenyltriazole-4-carboxamide;hydrochloride
CID 119566010

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride (CID 119566537) is N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride is Cl.NCC1(NC(=O)c2cnsn2)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride?
The InChIKey is AWNNSALXCBTAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4OS.ClH/c10-6-9(3-1-2-4-9)12-8(14)7-5-11-15-13-7;/h5H,1-4,6,10H2,(H,12,14);1H.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride?
N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride has a molecular weight of 262.77 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-1,2,5-thiadiazole-3-carboxamide;hydrochloride is sourced from PubChem (CID 119566537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).