1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride

C12H22ClF3N2O2 — CID 120916188

IUPAC1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride
SMILESCl.OC(CNC1CCCC1C1COCCN1)C(F)(F)F
InChIInChI=1S/C12H21F3N2O2.ClH/c13-12(14,15)11(18)6-17-9-3-1-2-8(9)10-7-19-5-4-16-10;/h8-11,16-18H,1-7H2;1H
InChIKeyZMXABSAJOQOPIB-UHFFFAOYSA-N
MW318.77 g/mol
LogP1.08
Rot. Bonds4

About 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride

1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride (PubChem CID 120916188) has the molecular formula C12H22ClF3N2O2 and a molecular weight of 318.77 g/mol. Its IUPAC name is 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride.

Molecular Properties

Compound Name1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride
PubChem CID120916188
Molecular FormulaC12H22ClF3N2O2
Molecular Weight318.77 g/mol
Exact Mass318.13
IUPAC Name1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride
SMILESCl.OC(CNC1CCCC1C1COCCN1)C(F)(F)F
InChIInChI=1S/C12H21F3N2O2.ClH/c13-12(14,15)11(18)6-17-9-3-1-2-8(9)10-7-19-5-4-16-10;/h8-11,16-18H,1-7H2;1H
InChIKeyZMXABSAJOQOPIB-UHFFFAOYSA-N
XLogP1.08
TPSA53.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.77
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclohexyl-2-[(2-morpholin-3-ylcyclopentyl)amino]ethanol
CID 120913923
1-(3,5-dichlorophenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]ethanol;hydrochloride
CID 120914540
N-(2-methylsulfanylpropyl)-2-morpholin-3-ylcyclopentan-1-amine
CID 120916191
2-morpholin-3-yl-N-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
CID 120914007
N-(cyclopentylmethyl)-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915794
1-cyclohexyl-N,N-dimethyl-N'-(2-morpholin-3-ylcyclopentyl)ethane-1,2-diamine;hydrochloride
CID 120915734
1-(2-methoxyphenyl)-2-[(2-morpholin-3-ylcyclopentyl)amino]ethanol;hydrochloride
CID 120914206
N-(3,3-dimethylbutyl)-2-morpholin-3-ylcyclopentan-1-amine
CID 120913877
2-morpholin-3-yl-N-(thiolan-2-ylmethyl)cyclopentan-1-amine;hydrochloride
CID 120915524
N-tert-butyl-2-[(2-morpholin-3-ylcyclopentyl)amino]acetamide;hydrochloride
CID 120915044
N-(cyclohexylmethyl)-2-morpholin-3-ylcyclopentan-1-amine
CID 120914381
2-morpholin-3-yl-N-(oxan-3-ylmethyl)cyclopentan-1-amine
CID 120914013

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride?
The IUPAC name of 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride (CID 120916188) is 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride.
What is the SMILES notation for 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride?
The canonical SMILES for 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride is Cl.OC(CNC1CCCC1C1COCCN1)C(F)(F)F.
What is the InChIKey of 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride?
The InChIKey is ZMXABSAJOQOPIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O2.ClH/c13-12(14,15)11(18)6-17-9-3-1-2-8(9)10-7-19-5-4-16-10;/h8-11,16-18H,1-7H2;1H.
What are the key properties of 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride?
1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride has a molecular weight of 318.77 g/mol, XLogP of 1.08, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoro-3-[(2-morpholin-3-ylcyclopentyl)amino]propan-2-ol;hydrochloride is sourced from PubChem (CID 120916188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).