N-(cyclopentylmethylsulfamoyl)propan-1-amine

C9H20N2O2S — CID 110627604

IUPACN-(cyclopentylmethylsulfamoyl)propan-1-amine
SMILESCCCNS(=O)(=O)NCC1CCCC1
InChIInChI=1S/C9H20N2O2S/c1-2-7-10-14(12,13)11-8-9-5-3-4-6-9/h9-11H,2-8H2,1H3
InChIKeyYWVLEEXRJHLFQR-UHFFFAOYSA-N
MW220.34 g/mol
LogP1.01
Rot. Bonds6

About N-(cyclopentylmethylsulfamoyl)propan-1-amine

N-(cyclopentylmethylsulfamoyl)propan-1-amine (PubChem CID 110627604) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is N-(cyclopentylmethylsulfamoyl)propan-1-amine.

Molecular Properties

Compound NameN-(cyclopentylmethylsulfamoyl)propan-1-amine
PubChem CID110627604
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC NameN-(cyclopentylmethylsulfamoyl)propan-1-amine
SMILESCCCNS(=O)(=O)NCC1CCCC1
InChIInChI=1S/C9H20N2O2S/c1-2-7-10-14(12,13)11-8-9-5-3-4-6-9/h9-11H,2-8H2,1H3
InChIKeyYWVLEEXRJHLFQR-UHFFFAOYSA-N
XLogP1.01
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(Cyclopentylmethyl)sulfamate
CID 23710972
Cyclopentylmethylsulfamic acid
CID 191351
2-propyl-N-(2,2,2-trifluoroethylsulfamoyl)butane-1,4-diamine
CID 114145477
1-(Dimethylsulfamoylamino)-4-methylpentane
CID 21021023
4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 22966185
3-[(Sulfinatoamino)methyl]heptane
CID 57135935
3,5,5-Trimethyl-1-(sulfinatoamino)hexane
CID 57421741
4-Methyl-1-(sulfamoylamino)pentane
CID 59849306
(Sulfinatoamino)methylcyclopentane
CID 68440606
3-(Sulfinatoamino)propylcyclopentane
CID 69520113
3-[(Sulfamoylamino)methyl]heptane
CID 87574850
3-Methyl-1-(sulfinatoamino)hexane
CID 91021820

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethylsulfamoyl)propan-1-amine?
The IUPAC name of N-(cyclopentylmethylsulfamoyl)propan-1-amine (CID 110627604) is N-(cyclopentylmethylsulfamoyl)propan-1-amine.
What is the SMILES notation for N-(cyclopentylmethylsulfamoyl)propan-1-amine?
The canonical SMILES for N-(cyclopentylmethylsulfamoyl)propan-1-amine is CCCNS(=O)(=O)NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethylsulfamoyl)propan-1-amine?
The InChIKey is YWVLEEXRJHLFQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-2-7-10-14(12,13)11-8-9-5-3-4-6-9/h9-11H,2-8H2,1H3.
What are the key properties of N-(cyclopentylmethylsulfamoyl)propan-1-amine?
N-(cyclopentylmethylsulfamoyl)propan-1-amine has a molecular weight of 220.34 g/mol, XLogP of 1.01, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethylsulfamoyl)propan-1-amine is sourced from PubChem (CID 110627604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).