3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide

C13H17FN2O3 — CID 22318780

IUPAC3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide
SMILESNC(=O)c1ccc(OCCN2CCOCC2)c(F)c1
InChIInChI=1S/C13H17FN2O3/c14-11-9-10(13(15)17)1-2-12(11)19-8-5-16-3-6-18-7-4-16/h1-2,9H,3-8H2,(H2,15,17)
InChIKeyQFAQJEXQKXXMHT-UHFFFAOYSA-N
MW268.29 g/mol
LogP0.64
Rot. Bonds5

About 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide

3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide (PubChem CID 22318780) has the molecular formula C13H17FN2O3 and a molecular weight of 268.29 g/mol. Its IUPAC name is 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide.

Molecular Properties

Compound Name3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide
PubChem CID22318780
Molecular FormulaC13H17FN2O3
Molecular Weight268.29 g/mol
Exact Mass268.12
IUPAC Name3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide
SMILESNC(=O)c1ccc(OCCN2CCOCC2)c(F)c1
InChIInChI=1S/C13H17FN2O3/c14-11-9-10(13(15)17)1-2-12(11)19-8-5-16-3-6-18-7-4-16/h1-2,9H,3-8H2,(H2,15,17)
InChIKeyQFAQJEXQKXXMHT-UHFFFAOYSA-N
XLogP0.64
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-4-(2-morpholin-4-ylethoxy)benzoic acid
CID 107689816
3-fluoro-4-(2-pyrrolidin-1-ylethoxy)benzamide
CID 22318837
4-(2-morpholin-4-ylethoxy)benzamide
CID 35813066
1-[3-amino-4-(2-morpholin-4-ylethoxy)phenyl]ethanone
CID 82064195
4-(2-morpholin-4-ylethoxy)-5,6,7,8-tetrahydronaphthalene-1-carboxamide
CID 70241021
hydron;2-morpholin-4-ylethyl 3,4-dimethoxybenzoate;chloride
CID 660605
methyl 4-methoxy-3-(3-morpholin-4-ylpropoxy)benzoate
CID 22466648
N-ethyl-3-methoxy-4-(2-morpholin-4-ylethoxy)benzamide
CID 166767320
4-[2-(2,3-difluoro-4-methylphenoxy)ethyl]morpholine
CID 123286014
2-[3-fluoro-4-(2-morpholin-4-ylethoxy)phenyl]-7-morpholin-4-yl-5H-pyrido[3,2-b]indole-4-carboxamide
CID 66604515
3-ethoxy-4-(morpholin-4-ylmethyl)benzamide
CID 68978840
[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]urea
CID 18628987

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide?
The IUPAC name of 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide (CID 22318780) is 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide.
What is the SMILES notation for 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide?
The canonical SMILES for 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide is NC(=O)c1ccc(OCCN2CCOCC2)c(F)c1.
What is the InChIKey of 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide?
The InChIKey is QFAQJEXQKXXMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O3/c14-11-9-10(13(15)17)1-2-12(11)19-8-5-16-3-6-18-7-4-16/h1-2,9H,3-8H2,(H2,15,17).
What are the key properties of 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide?
3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide has a molecular weight of 268.29 g/mol, XLogP of 0.64, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide is sourced from PubChem (CID 22318780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).