5-(cyclopropylsulfamoylamino)pentan-1-ol

C8H18N2O3S — CID 107319496

IUPAC5-(cyclopropylsulfamoylamino)pentan-1-ol
SMILESO=S(=O)(NCCCCCO)NC1CC1
InChIInChI=1S/C8H18N2O3S/c11-7-3-1-2-6-9-14(12,13)10-8-4-5-8/h8-11H,1-7H2
InChIKeyBRPTWTYZLQZVQG-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.26
Rot. Bonds8

About 5-(cyclopropylsulfamoylamino)pentan-1-ol

5-(cyclopropylsulfamoylamino)pentan-1-ol (PubChem CID 107319496) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 5-(cyclopropylsulfamoylamino)pentan-1-ol.

Molecular Properties

Compound Name5-(cyclopropylsulfamoylamino)pentan-1-ol
PubChem CID107319496
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name5-(cyclopropylsulfamoylamino)pentan-1-ol
SMILESO=S(=O)(NCCCCCO)NC1CC1
InChIInChI=1S/C8H18N2O3S/c11-7-3-1-2-6-9-14(12,13)10-8-4-5-8/h8-11H,1-7H2
InChIKeyBRPTWTYZLQZVQG-UHFFFAOYSA-N
XLogP-0.26
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(cyclopropylsulfamoylamino)methanol
CID 117126061
10-hydroxydecylsulfamic acid
CID 151793979
N-(4-hydroxybutyl)cyclohexanesulfonamide
CID 106843941
N-[2-(2-methylprop-2-enoxy)ethylsulfamoyl]cyclopropanamine
CID 114386504
4-(2,2,2-trifluoroethylsulfamoylamino)butan-1-ol
CID 106844053
1-cyclopropyl-2-(cyclopropylsulfamoylamino)ethanol
CID 114383309
5-[(cyclopropylamino)methyl]-N-(5-hydroxypentyl)furan-2-sulfonamide
CID 107323800
[5-hydroxypentylsulfamoyl(methyl)amino]cyclohexane
CID 107319547
N-[4-(4-methylphenyl)butylsulfamoyl]cyclopentanamine
CID 110627929
N-(2-pyrrolidin-3-ylethylsulfamoyl)cyclopropanamine
CID 114810747
1-[(cyclopropylsulfamoylamino)methyl]cyclopentan-1-ol
CID 114383287
3-(2-methylpropylsulfamoylamino)propan-1-ol
CID 114815587

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylsulfamoylamino)pentan-1-ol?
The IUPAC name of 5-(cyclopropylsulfamoylamino)pentan-1-ol (CID 107319496) is 5-(cyclopropylsulfamoylamino)pentan-1-ol.
What is the SMILES notation for 5-(cyclopropylsulfamoylamino)pentan-1-ol?
The canonical SMILES for 5-(cyclopropylsulfamoylamino)pentan-1-ol is O=S(=O)(NCCCCCO)NC1CC1.
What is the InChIKey of 5-(cyclopropylsulfamoylamino)pentan-1-ol?
The InChIKey is BRPTWTYZLQZVQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c11-7-3-1-2-6-9-14(12,13)10-8-4-5-8/h8-11H,1-7H2.
What are the key properties of 5-(cyclopropylsulfamoylamino)pentan-1-ol?
5-(cyclopropylsulfamoylamino)pentan-1-ol has a molecular weight of 222.31 g/mol, XLogP of -0.26, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylsulfamoylamino)pentan-1-ol is sourced from PubChem (CID 107319496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).