3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride

C11H24ClN3O3S — CID 119821617

IUPAC3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride
SMILESCC(N)CC(=O)NCC1CCCC1NS(C)(=O)=O.Cl
InChIInChI=1S/C11H23N3O3S.ClH/c1-8(12)6-11(15)13-7-9-4-3-5-10(9)14-18(2,16)17;/h8-10,14H,3-7,12H2,1-2H3,(H,13,15);1H
InChIKeyMRMDRFDAWSJANI-UHFFFAOYSA-N
MW313.85 g/mol
LogP-0.02
Rot. Bonds6

About 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride

3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride (PubChem CID 119821617) has the molecular formula C11H24ClN3O3S and a molecular weight of 313.85 g/mol. Its IUPAC name is 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride
PubChem CID119821617
Molecular FormulaC11H24ClN3O3S
Molecular Weight313.85 g/mol
Exact Mass313.12
IUPAC Name3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride
SMILESCC(N)CC(=O)NCC1CCCC1NS(C)(=O)=O.Cl
InChIInChI=1S/C11H23N3O3S.ClH/c1-8(12)6-11(15)13-7-9-4-3-5-10(9)14-18(2,16)17;/h8-10,14H,3-7,12H2,1-2H3,(H,13,15);1H
InChIKeyMRMDRFDAWSJANI-UHFFFAOYSA-N
XLogP-0.02
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.85
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]-3-methoxypropanamide;hydrochloride
CID 120992412
2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]-3-methoxypropanamide
CID 120992413
N-[[2-(methanesulfonamido)cyclopentyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 119821597
2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride
CID 119345236
2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]-3-methylpentanamide;hydrochloride
CID 119821615
2-(4-aminophenyl)-N-[[2-(methanesulfonamido)cyclopentyl]methyl]acetamide;hydrochloride
CID 119821585
(2R)-N-[[(1S,2R)-2-(methanesulfonamido)cyclopentyl]methyl]-2-methyl-3-methylsulfanylpropanamide
CID 124733780
3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]-2-methyl-3-phenylpropanamide;hydrochloride
CID 119821595
9-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120992414
N-[[2-(methanesulfonamido)cyclopentyl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119345210
2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]-2-methylpentanamide
CID 119821628
4-(aminomethyl)-N-[[2-(methanesulfonamido)cyclopentyl]methyl]oxane-4-carboxamide;hydrochloride
CID 120937422

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride?
The IUPAC name of 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride (CID 119821617) is 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride?
The canonical SMILES for 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride is CC(N)CC(=O)NCC1CCCC1NS(C)(=O)=O.Cl.
What is the InChIKey of 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride?
The InChIKey is MRMDRFDAWSJANI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3S.ClH/c1-8(12)6-11(15)13-7-9-4-3-5-10(9)14-18(2,16)17;/h8-10,14H,3-7,12H2,1-2H3,(H,13,15);1H.
What are the key properties of 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride?
3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride has a molecular weight of 313.85 g/mol, XLogP of -0.02, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride is sourced from PubChem (CID 119821617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).