2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide

C17H24FN3O3 — CID 120947167

IUPAC2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide
SMILESO=C(NCC1CNCC1O)C(c1cccc(F)c1)N1CCOCC1
InChIInChI=1S/C17H24FN3O3/c18-14-3-1-2-12(8-14)16(21-4-6-24-7-5-21)17(23)20-10-13-9-19-11-15(13)22/h1-3,8,13,15-16,19,22H,4-7,9-11H2,(H,20,23)
InChIKeySNYMYXUMWKYLJB-UHFFFAOYSA-N
MW337.40 g/mol
LogP-0.10
Rot. Bonds5

About 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide

2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide (PubChem CID 120947167) has the molecular formula C17H24FN3O3 and a molecular weight of 337.40 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide
PubChem CID120947167
Molecular FormulaC17H24FN3O3
Molecular Weight337.40 g/mol
Exact Mass337.18
IUPAC Name2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide
SMILESO=C(NCC1CNCC1O)C(c1cccc(F)c1)N1CCOCC1
InChIInChI=1S/C17H24FN3O3/c18-14-3-1-2-12(8-14)16(21-4-6-24-7-5-21)17(23)20-10-13-9-19-11-15(13)22/h1-3,8,13,15-16,19,22H,4-7,9-11H2,(H,20,23)
InChIKeySNYMYXUMWKYLJB-UHFFFAOYSA-N
XLogP-0.10
TPSA73.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 5-0.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-amino-2-methylpropyl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide;dihydrochloride
CID 119630100
N-(3-aminobutyl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide;dihydrochloride
CID 119499108
N-(2-cyanopropyl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide
CID 71998621
methyl 2-(3-fluorophenyl)-2-morpholin-4-ylacetate
CID 116860419
N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]morpholine-2-carboxamide;dihydrochloride
CID 119866007
(2S)-N-[4-[(carbamoylamino)methyl]phenyl]-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide
CID 97077185
2-(3-fluorophenyl)-1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-morpholin-4-ylethanone
CID 111561979
N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119865999
2-(3-fluorophenyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-morpholin-4-ylacetamide
CID 71912984
1-amino-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119865951
2-(2-fluorophenyl)sulfanyl-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-phenylacetamide
CID 120945699
(2S,4S)-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-2-methylpiperidine-4-carboxamide
CID 120634306

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide (CID 120947167) is 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide is O=C(NCC1CNCC1O)C(c1cccc(F)c1)N1CCOCC1.
What is the InChIKey of 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide?
The InChIKey is SNYMYXUMWKYLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FN3O3/c18-14-3-1-2-12(8-14)16(21-4-6-24-7-5-21)17(23)20-10-13-9-19-11-15(13)22/h1-3,8,13,15-16,19,22H,4-7,9-11H2,(H,20,23).
What are the key properties of 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide?
2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide has a molecular weight of 337.40 g/mol, XLogP of -0.10, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 120947167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).