N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride

C12H20ClN3O4S — CID 119568513

IUPACN-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride
SMILESCc1oc(C(=O)NC2(CN)CCCC2)cc1S(N)(=O)=O.Cl
InChIInChI=1S/C12H19N3O4S.ClH/c1-8-10(20(14,17)18)6-9(19-8)11(16)15-12(7-13)4-2-3-5-12;/h6H,2-5,7,13H2,1H3,(H,15,16)(H2,14,17,18);1H
InChIKeyIEPNJJNHZZGEMF-UHFFFAOYSA-N
MW337.83 g/mol
LogP0.66
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride

N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride (PubChem CID 119568513) has the molecular formula C12H20ClN3O4S and a molecular weight of 337.83 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride
PubChem CID119568513
Molecular FormulaC12H20ClN3O4S
Molecular Weight337.83 g/mol
Exact Mass337.09
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride
SMILESCc1oc(C(=O)NC2(CN)CCCC2)cc1S(N)(=O)=O.Cl
InChIInChI=1S/C12H19N3O4S.ClH/c1-8-10(20(14,17)18)6-9(19-8)11(16)15-12(7-13)4-2-3-5-12;/h6H,2-5,7,13H2,1H3,(H,15,16)(H2,14,17,18);1H
InChIKeyIEPNJJNHZZGEMF-UHFFFAOYSA-N
XLogP0.66
TPSA128.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.83
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-3-methyl-1,2-oxazole-5-carboxamide;hydrochloride
CID 119568167
N-cyclobutyl-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 65389029
N-cyclohexyl-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 65374556
N-(1-amino-2,3-dimethylbutan-2-yl)-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 119609057
N-(1-amino-4-methylpentan-2-yl)-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride
CID 119588835
N-[1-(aminomethyl)cyclopentyl]-3,5-dimethoxy-4-methylbenzamide
CID 119568346
N-[1-(aminomethyl)cyclopentyl]-4-hydroxy-3-methylbenzamide
CID 107672060
N-[1-(aminomethyl)cyclopentyl]-3-pentan-3-yl-1,2-oxazole-5-carboxamide;hydrochloride
CID 119565191
N-[1-(aminomethyl)cyclopentyl]-4-(methylsulfonylmethyl)benzamide
CID 119565747
5-methyl-4-sulfamoyl-N-(3-tricyclo[3.2.1.02,4]octanyl)furan-2-carboxamide
CID 103767080
4-acetyl-N-[1-(aminomethyl)cyclopentyl]benzamide;hydrochloride
CID 119564862
N-[1-(aminomethyl)cyclopentyl]-3-fluoro-4-methylbenzamide;hydrochloride
CID 119566431

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride (CID 119568513) is N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride is Cc1oc(C(=O)NC2(CN)CCCC2)cc1S(N)(=O)=O.Cl.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride?
The InChIKey is IEPNJJNHZZGEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O4S.ClH/c1-8-10(20(14,17)18)6-9(19-8)11(16)15-12(7-13)4-2-3-5-12;/h6H,2-5,7,13H2,1H3,(H,15,16)(H2,14,17,18);1H.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride?
N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride has a molecular weight of 337.83 g/mol, XLogP of 0.66, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride is sourced from PubChem (CID 119568513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).