N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride

C15H20ClFN2O2 — CID 119731232

IUPACN-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCC1(c2ccc(F)cc2)CC1)C1CNCCO1
InChIInChI=1S/C15H19FN2O2.ClH/c16-12-3-1-11(2-4-12)15(5-6-15)10-18-14(19)13-9-17-7-8-20-13;/h1-4,13,17H,5-10H2,(H,18,19);1H
InChIKeyGRDGACOVLGAJGU-UHFFFAOYSA-N
MW314.79 g/mol
LogP1.38
Rot. Bonds4

About N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride

N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119731232) has the molecular formula C15H20ClFN2O2 and a molecular weight of 314.79 g/mol. Its IUPAC name is N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119731232
Molecular FormulaC15H20ClFN2O2
Molecular Weight314.79 g/mol
Exact Mass314.12
IUPAC NameN-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCC1(c2ccc(F)cc2)CC1)C1CNCCO1
InChIInChI=1S/C15H19FN2O2.ClH/c16-12-3-1-11(2-4-12)15(5-6-15)10-18-14(19)13-9-17-7-8-20-13;/h1-4,13,17H,5-10H2,(H,18,19);1H
InChIKeyGRDGACOVLGAJGU-UHFFFAOYSA-N
XLogP1.38
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.79
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(4-fluorophenyl)cyclobutyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119761194
N-[[1-(4-chlorophenyl)cyclobutyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119769970
N-[[4-(4-fluorophenyl)oxan-4-yl]methyl]piperidine-3-carboxamide;hydrochloride
CID 119303720
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]piperidine-3-carboxamide;hydrochloride
CID 119293576
N-[[1-(2-methylphenyl)cyclohexyl]methyl]morpholine-2-carboxamide
CID 119767062
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]piperidine-3-carboxamide
CID 119293577
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-3-carboxamide
CID 119731196
N-[2-(4-fluorophenoxy)propyl]morpholine-2-carboxamide
CID 119804499
N-[(1-ethylcyclobutyl)methyl]morpholine-2-carboxamide;hydrochloride
CID 119782167
N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide
CID 119310492
N-[[1-(4-fluorophenyl)cyclobutyl]methyl]morpholine-3-carboxamide;hydrochloride
CID 119761154
1-[(morpholine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid
CID 115445861

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride (CID 119731232) is N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride is Cl.O=C(NCC1(c2ccc(F)cc2)CC1)C1CNCCO1.
What is the InChIKey of N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is GRDGACOVLGAJGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2.ClH/c16-12-3-1-11(2-4-12)15(5-6-15)10-18-14(19)13-9-17-7-8-20-13;/h1-4,13,17H,5-10H2,(H,18,19);1H.
What are the key properties of N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride?
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 314.79 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-fluorophenyl)cyclopropyl]methyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119731232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).