N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide

C10H20ClNO2S — CID 106288751

IUPACN-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide
SMILESCCC(CC)C(Cl)CNS(=O)(=O)C1CC1
InChIInChI=1S/C10H20ClNO2S/c1-3-8(4-2)10(11)7-12-15(13,14)9-5-6-9/h8-10,12H,3-7H2,1-2H3
InChIKeyZQKKLGCQMQQJFX-UHFFFAOYSA-N
MW253.79 g/mol
LogP2.11
Rot. Bonds7

About N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide

N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide (PubChem CID 106288751) has the molecular formula C10H20ClNO2S and a molecular weight of 253.79 g/mol. Its IUPAC name is N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide
PubChem CID106288751
Molecular FormulaC10H20ClNO2S
Molecular Weight253.79 g/mol
Exact Mass253.09
IUPAC NameN-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide
SMILESCCC(CC)C(Cl)CNS(=O)(=O)C1CC1
InChIInChI=1S/C10H20ClNO2S/c1-3-8(4-2)10(11)7-12-15(13,14)9-5-6-9/h8-10,12H,3-7H2,1-2H3
InChIKeyZQKKLGCQMQQJFX-UHFFFAOYSA-N
XLogP2.11
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.79
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-3-ethylpentyl)oxane-4-sulfonamide
CID 114168552
N-(2-ethylbutyl)cyclopentanesulfonamide
CID 115613328
methyl N-[(2-chloro-3-ethylpentyl)sulfamoyl]carbamate
CID 106288784
2-[(cyclopentylsulfonylamino)methyl]butanoic acid
CID 105360867
N-(3-chloro-2-methylpropyl)cyclopentanesulfonamide
CID 105361722
N-[(2S)-2-[(1-ethylcyclobutyl)methylamino]propyl]cyclopropanesulfonamide
CID 164640887
N-(2-cyanopropyl)oxane-4-sulfonamide
CID 62653493
N-(2-hydroxypropyl)oxane-4-sulfonamide
CID 62050306
N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide
CID 83029694
methyl 3-(cyclopropylsulfonylamino)-2-iodopropanoate
CID 103493669
N-[2-(2-chloroethyl)pentyl]oxane-4-sulfonamide
CID 114145876
methyl 2-chloro-3-(cyclohexylsulfonylamino)propanoate
CID 103493513

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide?
The IUPAC name of N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide (CID 106288751) is N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide?
The canonical SMILES for N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide is CCC(CC)C(Cl)CNS(=O)(=O)C1CC1.
What is the InChIKey of N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide?
The InChIKey is ZQKKLGCQMQQJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20ClNO2S/c1-3-8(4-2)10(11)7-12-15(13,14)9-5-6-9/h8-10,12H,3-7H2,1-2H3.
What are the key properties of N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide?
N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide has a molecular weight of 253.79 g/mol, XLogP of 2.11, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3-ethylpentyl)cyclopropanesulfonamide is sourced from PubChem (CID 106288751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).