3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide

C16H21FN2O2 — CID 139028737

IUPAC3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
SMILESO=C(NCC1(N2CCOCC2)CCC1)c1cccc(F)c1
InChIInChI=1S/C16H21FN2O2/c17-14-4-1-3-13(11-14)15(20)18-12-16(5-2-6-16)19-7-9-21-10-8-19/h1,3-4,11H,2,5-10,12H2,(H,18,20)
InChIKeyYUARBYFMKXZVGD-UHFFFAOYSA-N
MW292.35 g/mol
LogP1.81
Rot. Bonds4

About 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide

3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide (PubChem CID 139028737) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide.

Molecular Properties

Compound Name3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
PubChem CID139028737
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC Name3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
SMILESO=C(NCC1(N2CCOCC2)CCC1)c1cccc(F)c1
InChIInChI=1S/C16H21FN2O2/c17-14-4-1-3-13(11-14)15(20)18-12-16(5-2-6-16)19-7-9-21-10-8-19/h1,3-4,11H,2,5-10,12H2,(H,18,20)
InChIKeyYUARBYFMKXZVGD-UHFFFAOYSA-N
XLogP1.81
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-[(1-methyl-4-morpholin-4-ylpiperidin-4-yl)methyl]benzamide
CID 112505015
3-fluoro-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]benzamide
CID 78784195
3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 18150674
N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-pyrrol-1-ylbenzamide
CID 17404060
3-fluoro-4-methoxy-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
CID 139028774
N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-piperidin-1-ylsulfonylbenzamide
CID 17391709
3-methoxy-N-[(4-morpholin-4-yloxan-4-yl)methyl]benzamide
CID 125420203
2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 39430130
2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide;hydrochloride
CID 20995028
3-bromo-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]benzamide
CID 18150703
5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 18150722
2,5-dichloro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
CID 139027826

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide?
The IUPAC name of 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide (CID 139028737) is 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide.
What is the SMILES notation for 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide?
The canonical SMILES for 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide is O=C(NCC1(N2CCOCC2)CCC1)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide?
The InChIKey is YUARBYFMKXZVGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c17-14-4-1-3-13(11-14)15(20)18-12-16(5-2-6-16)19-7-9-21-10-8-19/h1,3-4,11H,2,5-10,12H2,(H,18,20).
What are the key properties of 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide?
3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide has a molecular weight of 292.35 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide is sourced from PubChem (CID 139028737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).