N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide

C11H23N3O3S — CID 119566219

IUPACN-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide
SMILESCCS(=O)(=O)N(C)CC(=O)NC1(CN)CCCC1
InChIInChI=1S/C11H23N3O3S/c1-3-18(16,17)14(2)8-10(15)13-11(9-12)6-4-5-7-11/h3-9,12H2,1-2H3,(H,13,15)
InChIKeyTUUBLOHGPMUCQJ-UHFFFAOYSA-N
MW277.39 g/mol
LogP-0.34
Rot. Bonds6

About N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide

N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide (PubChem CID 119566219) has the molecular formula C11H23N3O3S and a molecular weight of 277.39 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide
PubChem CID119566219
Molecular FormulaC11H23N3O3S
Molecular Weight277.39 g/mol
Exact Mass277.15
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide
SMILESCCS(=O)(=O)N(C)CC(=O)NC1(CN)CCCC1
InChIInChI=1S/C11H23N3O3S/c1-3-18(16,17)14(2)8-10(15)13-11(9-12)6-4-5-7-11/h3-9,12H2,1-2H3,(H,13,15)
InChIKeyTUUBLOHGPMUCQJ-UHFFFAOYSA-N
XLogP-0.34
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-2-ethylsulfonylacetamide
CID 119566982
N-[1-(aminomethyl)cyclopentyl]-2-[(4-chlorophenyl)sulfonyl-methylamino]acetamide
CID 119565832
3-[1-(aminomethyl)cyclopentyl]-1,1-dimethylurea
CID 79154067
N-[1-(aminomethyl)cyclopentyl]-3-methylhexanamide
CID 119566665
N-[1-(aminomethyl)cyclopentyl]-4-(dipropylamino)butanamide;dihydrochloride
CID 119566129
methyl N-[1-(aminomethyl)cyclohexyl]carbamate
CID 63765596
N-[1-(aminomethyl)cyclohexyl]-2-methoxyacetamide
CID 63755662
N-[1-(aminomethyl)cyclopentyl]-3,3-dimethylbutanamide;hydrochloride
CID 119565263
N-[1-(aminomethyl)cyclopentyl]-3-butylsulfanylpropanamide
CID 119568512
N-[2-[[1-(aminomethyl)cyclopentyl]amino]-2-oxoethyl]-2,2-dimethylpropanamide;hydrochloride
CID 119566804
N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride
CID 119568443
N-[1-(aminomethyl)cyclopentyl]-3-(2-methylpropylsulfonyl)propanamide;hydrochloride
CID 119565990

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide (CID 119566219) is N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide is CCS(=O)(=O)N(C)CC(=O)NC1(CN)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide?
The InChIKey is TUUBLOHGPMUCQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3S/c1-3-18(16,17)14(2)8-10(15)13-11(9-12)6-4-5-7-11/h3-9,12H2,1-2H3,(H,13,15).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide?
N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide has a molecular weight of 277.39 g/mol, XLogP of -0.34, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide is sourced from PubChem (CID 119566219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).