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

C12H26ClN3O3S — CID 119345236

IUPAC2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NCC1CCCC1NS(C)(=O)=O.Cl
InChIInChI=1S/C12H25N3O3S.ClH/c1-3-5-10(13)12(16)14-8-9-6-4-7-11(9)15-19(2,17)18;/h9-11,15H,3-8,13H2,1-2H3,(H,14,16);1H
InChIKeyDROJHTQWHOTDAR-UHFFFAOYSA-N
MW327.88 g/mol
LogP0.37
Rot. Bonds7

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

2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride (PubChem CID 119345236) has the molecular formula C12H26ClN3O3S and a molecular weight of 327.88 g/mol. Its IUPAC name is 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride
PubChem CID119345236
Molecular FormulaC12H26ClN3O3S
Molecular Weight327.88 g/mol
Exact Mass327.14
IUPAC Name2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NCC1CCCC1NS(C)(=O)=O.Cl
InChIInChI=1S/C12H25N3O3S.ClH/c1-3-5-10(13)12(16)14-8-9-6-4-7-11(9)15-19(2,17)18;/h9-11,15H,3-8,13H2,1-2H3,(H,14,16);1H
InChIKeyDROJHTQWHOTDAR-UHFFFAOYSA-N
XLogP0.37
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.88
LogP ≤ 50.37
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
2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]-3-methylpentanamide;hydrochloride
CID 119821615
3-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]butanamide;hydrochloride
CID 119821617
(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
2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]-2-methylpentanamide
CID 119821628
N-[[2-(methanesulfonamido)cyclopentyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 119821597
N-[[2-(methanesulfonamido)cyclopentyl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119345210
4-(aminomethyl)-N-[[2-(methanesulfonamido)cyclopentyl]methyl]oxane-4-carboxamide;hydrochloride
CID 120937422
(2S)-2-amino-N-(2-cyclobutylethyl)pentanamide
CID 107570634
9-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120992414

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride (CID 119345236) is 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride is CCCC(N)C(=O)NCC1CCCC1NS(C)(=O)=O.Cl.
What is the InChIKey of 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride?
The InChIKey is DROJHTQWHOTDAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3S.ClH/c1-3-5-10(13)12(16)14-8-9-6-4-7-11(9)15-19(2,17)18;/h9-11,15H,3-8,13H2,1-2H3,(H,14,16);1H.
What are the key properties of 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride?
2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride has a molecular weight of 327.88 g/mol, XLogP of 0.37, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[2-(methanesulfonamido)cyclopentyl]methyl]pentanamide;hydrochloride is sourced from PubChem (CID 119345236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).