N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride

C15H30ClN3O3S — CID 119568443

IUPACN-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride
SMILESCC1CCC(NS(=O)(=O)CC(=O)NC2(CN)CCCC2)CC1.Cl
InChIInChI=1S/C15H29N3O3S.ClH/c1-12-4-6-13(7-5-12)18-22(20,21)10-14(19)17-15(11-16)8-2-3-9-15;/h12-13,18H,2-11,16H2,1H3,(H,17,19);1H
InChIKeyCNYMYNNWRBFDJR-UHFFFAOYSA-N
MW367.94 g/mol
LogP1.29
Rot. Bonds6

About N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride

N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride (PubChem CID 119568443) has the molecular formula C15H30ClN3O3S and a molecular weight of 367.94 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride
PubChem CID119568443
Molecular FormulaC15H30ClN3O3S
Molecular Weight367.94 g/mol
Exact Mass367.17
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride
SMILESCC1CCC(NS(=O)(=O)CC(=O)NC2(CN)CCCC2)CC1.Cl
InChIInChI=1S/C15H29N3O3S.ClH/c1-12-4-6-13(7-5-12)18-22(20,21)10-14(19)17-15(11-16)8-2-3-9-15;/h12-13,18H,2-11,16H2,1H3,(H,17,19);1H
InChIKeyCNYMYNNWRBFDJR-UHFFFAOYSA-N
XLogP1.29
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.94
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-2-ethylsulfonylacetamide
CID 119566982
N-[(2S)-1-aminopropan-2-yl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride
CID 120507600
N-(4-aminocyclohexyl)-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride
CID 119479042
N-(2-amino-2-ethylbutyl)-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride
CID 119643886
2-[(4-methylcyclohexyl)sulfamoyl]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 154747604
N-[1-(aminomethyl)-4-methylcyclohexyl]butanamide
CID 63766676
N-[1-(aminomethyl)cyclohexyl]-5-methyloxolane-2-carboxamide
CID 81327458
ethyl (2S)-2-[[2-[(4-methylcyclohexyl)sulfamoyl]acetyl]amino]propanoate
CID 52873250
2-[(4-methylcyclohexyl)sulfamoyl]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120575817
N-[1-(aminomethyl)cyclopentyl]-2-[ethylsulfonyl(methyl)amino]acetamide
CID 119566219
N-[1-(aminomethyl)-4-methylcyclohexyl]-2-propoxyacetamide
CID 107941605
2-[(4-methylcyclohexyl)sulfamoyl]-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]acetamide
CID 95284178

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride (CID 119568443) is N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride is CC1CCC(NS(=O)(=O)CC(=O)NC2(CN)CCCC2)CC1.Cl.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride?
The InChIKey is CNYMYNNWRBFDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O3S.ClH/c1-12-4-6-13(7-5-12)18-22(20,21)10-14(19)17-15(11-16)8-2-3-9-15;/h12-13,18H,2-11,16H2,1H3,(H,17,19);1H.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride?
N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride has a molecular weight of 367.94 g/mol, XLogP of 1.29, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-2-[(4-methylcyclohexyl)sulfamoyl]acetamide;hydrochloride is sourced from PubChem (CID 119568443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).