N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride

C15H31ClN2O3S — CID 120916306

IUPACN-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
SMILESCC(C)(C)S(=O)(=O)CCNC1CCCC1C1COCCN1.Cl
InChIInChI=1S/C15H30N2O3S.ClH/c1-15(2,3)21(18,19)10-8-17-13-6-4-5-12(13)14-11-20-9-7-16-14;/h12-14,16-17H,4-11H2,1-3H3;1H
InChIKeyZSYXKWJPIWHZQN-UHFFFAOYSA-N
MW354.94 g/mol
LogP1.37
Rot. Bonds5

About N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride

N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride (PubChem CID 120916306) has the molecular formula C15H31ClN2O3S and a molecular weight of 354.94 g/mol. Its IUPAC name is N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride.

Molecular Properties

Compound NameN-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
PubChem CID120916306
Molecular FormulaC15H31ClN2O3S
Molecular Weight354.94 g/mol
Exact Mass354.17
IUPAC NameN-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
SMILESCC(C)(C)S(=O)(=O)CCNC1CCCC1C1COCCN1.Cl
InChIInChI=1S/C15H30N2O3S.ClH/c1-15(2,3)21(18,19)10-8-17-13-6-4-5-12(13)14-11-20-9-7-16-14;/h12-14,16-17H,4-11H2,1-3H3;1H
InChIKeyZSYXKWJPIWHZQN-UHFFFAOYSA-N
XLogP1.37
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.94
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,3-dimethylbutyl)-2-morpholin-3-ylcyclopentan-1-amine
CID 120913877
N-[2-(benzenesulfonyl)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915822
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915656
N-tert-butyl-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide;hydrochloride
CID 120915044
2-morpholin-3-yl-N-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
CID 120914007
N-(cyclopentylmethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915794
N-[(2-tert-butyloxan-3-yl)methyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120914546
1-(4-methylpiperazin-1-yl)-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-1-one;hydrochloride
CID 120914078
N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120916417
N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine
CID 120914381
1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride
CID 120916188
N-[2-(3-tert-butylphenoxy)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120916338

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride?
The IUPAC name of N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride (CID 120916306) is N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride.
What is the SMILES notation for N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride?
The canonical SMILES for N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride is CC(C)(C)S(=O)(=O)CCNC1CCCC1C1COCCN1.Cl.
What is the InChIKey of N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride?
The InChIKey is ZSYXKWJPIWHZQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3S.ClH/c1-15(2,3)21(18,19)10-8-17-13-6-4-5-12(13)14-11-20-9-7-16-14;/h12-14,16-17H,4-11H2,1-3H3;1H.
What are the key properties of N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride?
N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride has a molecular weight of 354.94 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylsulfonylethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride is sourced from PubChem (CID 120916306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).