N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride

C12H20ClF3N2O2 — CID 119820558

IUPACN-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NC(C1CCCC1)C(F)(F)F)C1CNCCO1
InChIInChI=1S/C12H19F3N2O2.ClH/c13-12(14,15)10(8-3-1-2-4-8)17-11(18)9-7-16-5-6-19-9;/h8-10,16H,1-7H2,(H,17,18);1H
InChIKeyVZUHAWCMYSKJPR-UHFFFAOYSA-N
MW316.75 g/mol
LogP1.63
Rot. Bonds3

About N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride

N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119820558) has the molecular formula C12H20ClF3N2O2 and a molecular weight of 316.75 g/mol. Its IUPAC name is N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119820558
Molecular FormulaC12H20ClF3N2O2
Molecular Weight316.75 g/mol
Exact Mass316.12
IUPAC NameN-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NC(C1CCCC1)C(F)(F)F)C1CNCCO1
InChIInChI=1S/C12H19F3N2O2.ClH/c13-12(14,15)10(8-3-1-2-4-8)17-11(18)9-7-16-5-6-19-9;/h8-10,16H,1-7H2,(H,17,18);1H
InChIKeyVZUHAWCMYSKJPR-UHFFFAOYSA-N
XLogP1.63
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.75
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-cyclopentylmorpholine-2-carboxamide
CID 92614945
(2R)-N-(1-cyclopropylethyl)morpholine-2-carboxamide
CID 131110683
N-(1-cyclopropylpropan-2-yl)morpholine-2-carboxamide;hydrochloride
CID 119784606
N-[1-(oxan-4-yl)ethyl]morpholine-2-carboxamide
CID 103812297
N-(3-propan-2-ylcyclohexyl)morpholine-2-carboxamide;hydrochloride
CID 119775875
N-(1-cyclopentyl-2,2,2-trifluoroethyl)-2-azaspiro[4.5]decane-8-carboxamide
CID 166270302
N-[(2R)-1-amino-1-oxopropan-2-yl]morpholine-2-carboxamide
CID 130549246
N-(3-cyclohexylpropyl)morpholine-2-carboxamide;hydrochloride
CID 119724280
methyl (2R)-2-(morpholine-2-carbonylamino)propanoate
CID 119781299
(2S)-N-(cyclobutylmethyl)morpholine-2-carboxamide;hydrochloride
CID 131065842
N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride
CID 119786670
N-[1-(dimethylamino)-4-methylpentan-2-yl]morpholine-2-carboxamide;dihydrochloride
CID 119855874

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride (CID 119820558) is N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride is Cl.O=C(NC(C1CCCC1)C(F)(F)F)C1CNCCO1.
What is the InChIKey of N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is VZUHAWCMYSKJPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19F3N2O2.ClH/c13-12(14,15)10(8-3-1-2-4-8)17-11(18)9-7-16-5-6-19-9;/h8-10,16H,1-7H2,(H,17,18);1H.
What are the key properties of N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride?
N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 316.75 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentyl-2,2,2-trifluoroethyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119820558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).