4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide

C10H22N2O3S — CID 62087494

IUPAC4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide
SMILESCOC1CCCC1NS(=O)(=O)CCCCN
InChIInChI=1S/C10H22N2O3S/c1-15-10-6-4-5-9(10)12-16(13,14)8-3-2-7-11/h9-10,12H,2-8,11H2,1H3
InChIKeyWQCVYPQVNLUKGC-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.21
Rot. Bonds7

About 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide

4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide (PubChem CID 62087494) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide
PubChem CID62087494
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide
SMILESCOC1CCCC1NS(=O)(=O)CCCCN
InChIInChI=1S/C10H22N2O3S/c1-15-10-6-4-5-9(10)12-16(13,14)8-3-2-7-11/h9-10,12H,2-8,11H2,1H3
InChIKeyWQCVYPQVNLUKGC-UHFFFAOYSA-N
XLogP0.21
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-N-(2-methoxycyclopentyl)methanesulfonamide
CID 63665826
3-amino-N-(2,3-dimethylcyclohexyl)propane-1-sulfonamide
CID 60909960
2-amino-N-(2-methylcyclopentyl)ethanesulfonamide
CID 63281586
5-(2-aminoethyl)-N-(2-methoxycyclopentyl)thiophene-2-sulfonamide
CID 55033280
1-(3-aminophenyl)-N-(2-methoxycyclopentyl)methanesulfonamide
CID 55033603
5-(aminomethyl)-3-bromo-N-(2-methoxycyclopentyl)-2-methylbenzenesulfonamide
CID 81481552
4-N-(2-methoxycyclopentyl)benzene-1,4-disulfonamide
CID 62088805
methyl 4-[(2-carbamothioylcyclopentyl)sulfamoyl]butanoate
CID 62957123
2-methoxy-N-propan-2-ylcyclopentan-1-amine
CID 62088372
cis-(1R,2S)-2-methoxy-N-propan-2-ylcyclopentan-1-amine
CID 94347863
3-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-4-sulfonamide
CID 62087291
4-(cyclopropylamino)-N-(2-methylcyclopentyl)butane-1-sulfonamide
CID 106064397

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide?
The IUPAC name of 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide (CID 62087494) is 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide.
What is the SMILES notation for 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide?
The canonical SMILES for 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide is COC1CCCC1NS(=O)(=O)CCCCN.
What is the InChIKey of 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide?
The InChIKey is WQCVYPQVNLUKGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-15-10-6-4-5-9(10)12-16(13,14)8-3-2-7-11/h9-10,12H,2-8,11H2,1H3.
What are the key properties of 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide?
4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.21, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-methoxycyclopentyl)butane-1-sulfonamide is sourced from PubChem (CID 62087494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).