N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide

C19H21FN2O2 — CID 46522835

IUPACN-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide
SMILESO=C(NCC1CN(Cc2ccccc2)CCO1)c1ccc(F)cc1
InChIInChI=1S/C19H21FN2O2/c20-17-8-6-16(7-9-17)19(23)21-12-18-14-22(10-11-24-18)13-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H,21,23)
InChIKeyREPQKMHQPZQYEO-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.46
Rot. Bonds5

About N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide

N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide (PubChem CID 46522835) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide.

Molecular Properties

Compound NameN-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide
PubChem CID46522835
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC NameN-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide
SMILESO=C(NCC1CN(Cc2ccccc2)CCO1)c1ccc(F)cc1
InChIInChI=1S/C19H21FN2O2/c20-17-8-6-16(7-9-17)19(23)21-12-18-14-22(10-11-24-18)13-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H,21,23)
InChIKeyREPQKMHQPZQYEO-UHFFFAOYSA-N
XLogP2.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(4-benzylmorpholin-2-yl)methylamino]-2-oxoethyl]-4-fluorobenzamide
CID 24640639
N-[(4-benzylmorpholin-2-yl)methyl]pyridine-4-carboxamide
CID 43019906
(4-benzylmorpholin-2-yl)methylcarbamic acid
CID 21104645
N-[(4-benzylmorpholin-2-yl)methyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 42886737
N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide
CID 42939286
N-[(4-benzylmorpholin-2-yl)methyl]-3-(4-fluorophenyl)sulfanylpropanamide
CID 43064031
N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2-(2-fluorophenyl)acetamide
CID 39472038
N-[(4-benzylmorpholin-2-yl)methyl]-3,5-dimethoxybenzamide
CID 17480503
N-[(4-benzylmorpholin-2-yl)methyl]-2-chloroquinoline-6-carboxamide
CID 55731163
N-[[4-(2-phenylethyl)morpholin-2-yl]methyl]benzamide
CID 90904746
N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-4-(prop-2-enylsulfamoyl)benzamide
CID 27809540
N-[(4-benzylmorpholin-2-yl)methyl]-3-(dimethylamino)benzamide
CID 78799093

Frequently Asked Questions

What is the IUPAC name of N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide?
The IUPAC name of N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide (CID 46522835) is N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide.
What is the SMILES notation for N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide?
The canonical SMILES for N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide is O=C(NCC1CN(Cc2ccccc2)CCO1)c1ccc(F)cc1.
What is the InChIKey of N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide?
The InChIKey is REPQKMHQPZQYEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O2/c20-17-8-6-16(7-9-17)19(23)21-12-18-14-22(10-11-24-18)13-15-4-2-1-3-5-15/h1-9,18H,10-14H2,(H,21,23).
What are the key properties of N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide?
N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide has a molecular weight of 328.39 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide is sourced from PubChem (CID 46522835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).