3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine

C10H23N3O2S — CID 106125517

IUPAC3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine
SMILESCC(C)(C)NS(=O)(=O)NCC1CCC(N)C1
InChIInChI=1S/C10H23N3O2S/c1-10(2,3)13-16(14,15)12-7-8-4-5-9(11)6-8/h8-9,12-13H,4-7,11H2,1-3H3
InChIKeySLLRQYKINUWQHE-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.34
Rot. Bonds4

About 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine

3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine (PubChem CID 106125517) has the molecular formula C10H23N3O2S and a molecular weight of 249.38 g/mol. Its IUPAC name is 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine
PubChem CID106125517
Molecular FormulaC10H23N3O2S
Molecular Weight249.38 g/mol
Exact Mass249.15
IUPAC Name3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine
SMILESCC(C)(C)NS(=O)(=O)NCC1CCC(N)C1
InChIInChI=1S/C10H23N3O2S/c1-10(2,3)13-16(14,15)12-7-8-4-5-9(11)6-8/h8-9,12-13H,4-7,11H2,1-3H3
InChIKeySLLRQYKINUWQHE-UHFFFAOYSA-N
XLogP0.34
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine
CID 106125410
3-methyl-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine
CID 114807280
(3-Methylcyclopentyl)sulfamic acid
CID 19748602
4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 22966185
sodium N-(3-methylcyclopentyl)sulfamate
CID 23690699
N-(3-ethylcyclopentyl)methanesulfonamide
CID 68260673
3-Methyl-2-(sulfamoylamino)heptane
CID 154426138
N-[1-(aminomethyl)-3-methylcyclopentyl]methanesulfonamide
CID 157547771
methane;4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 160469218
calcium bis(N-(3-methylcyclopentyl)sulfamate)
CID 162097644
ethane;N-(3-methylcyclopentyl)methanesulfonamide
CID 167493684
ethane;N-(3-methylcyclopentyl)methanesulfonamide
CID 167493893

Frequently Asked Questions

What is the IUPAC name of 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine?
The IUPAC name of 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine (CID 106125517) is 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine is CC(C)(C)NS(=O)(=O)NCC1CCC(N)C1.
What is the InChIKey of 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine?
The InChIKey is SLLRQYKINUWQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2S/c1-10(2,3)13-16(14,15)12-7-8-4-5-9(11)6-8/h8-9,12-13H,4-7,11H2,1-3H3.
What are the key properties of 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine?
3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine has a molecular weight of 249.38 g/mol, XLogP of 0.34, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(tert-butylsulfamoylamino)methyl]cyclopentan-1-amine is sourced from PubChem (CID 106125517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).