N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide

C16H22FNO3 — CID 102866340

IUPACN-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
SMILESO=C(CCOc1cccc(F)c1)N(CCCO)C1CCC1
InChIInChI=1S/C16H22FNO3/c17-13-4-1-7-15(12-13)21-11-8-16(20)18(9-3-10-19)14-5-2-6-14/h1,4,7,12,14,19H,2-3,5-6,8-11H2
InChIKeyYVRQIISVMHBMHG-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.36
Rot. Bonds8

About N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide

N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide (PubChem CID 102866340) has the molecular formula C16H22FNO3 and a molecular weight of 295.35 g/mol. Its IUPAC name is N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide.

Molecular Properties

Compound NameN-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
PubChem CID102866340
Molecular FormulaC16H22FNO3
Molecular Weight295.35 g/mol
Exact Mass295.16
IUPAC NameN-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
SMILESO=C(CCOc1cccc(F)c1)N(CCCO)C1CCC1
InChIInChI=1S/C16H22FNO3/c17-13-4-1-7-15(12-13)21-11-8-16(20)18(9-3-10-19)14-5-2-6-14/h1,4,7,12,14,19H,2-3,5-6,8-11H2
InChIKeyYVRQIISVMHBMHG-UHFFFAOYSA-N
XLogP2.36
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-fluorophenoxy)-N-(2-hydroxycyclohexyl)-N-methylpropanamide
CID 102634743
N-cyclobutyl-2-(2,4-difluorophenoxy)-N-(3-hydroxypropyl)acetamide
CID 102866483
4-(3-fluorophenoxy)-N-methyl-N-pyrrolidin-3-ylbutanamide
CID 119553657
N-cyclobutyl-3-(4-fluorophenyl)sulfanyl-N-(3-hydroxypropyl)propanamide
CID 102866164
3-[3-(3-fluorophenoxy)propanoyl-methylamino]propanoic acid
CID 60989974
3-(4-bromophenoxy)-N-cyclobutyl-N-(2-hydroxyethyl)propanamide
CID 102684243
3-(3-fluorophenoxy)-N-[2-(hydroxymethyl)cyclopentyl]propanamide
CID 103774376
4-chloro-N-[2-(3-fluorophenoxy)ethyl]-N-methylbutanamide
CID 63307611
3-[2-[cyclobutyl(3-hydroxypropyl)amino]ethoxy]benzoic acid
CID 102863854
N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide
CID 60729344
2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide
CID 54872660
3-(3-fluorophenoxy)-1-piperidin-1-ylpropan-1-one
CID 60739345

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide?
The IUPAC name of N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide (CID 102866340) is N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide.
What is the SMILES notation for N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide?
The canonical SMILES for N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide is O=C(CCOc1cccc(F)c1)N(CCCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide?
The InChIKey is YVRQIISVMHBMHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO3/c17-13-4-1-7-15(12-13)21-11-8-16(20)18(9-3-10-19)14-5-2-6-14/h1,4,7,12,14,19H,2-3,5-6,8-11H2.
What are the key properties of N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide?
N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide has a molecular weight of 295.35 g/mol, XLogP of 2.36, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-3-(3-fluorophenoxy)-N-(3-hydroxypropyl)propanamide is sourced from PubChem (CID 102866340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).