N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide

C19H26FN3O3 — CID 124831920

IUPACN-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide
SMILESCC(=O)N[C@H]1CCCN(C(=O)CN2CCO[C@@H](c3ccc(F)cc3)C2)C1
InChIInChI=1S/C19H26FN3O3/c1-14(24)21-17-3-2-8-23(11-17)19(25)13-22-9-10-26-18(12-22)15-4-6-16(20)7-5-15/h4-7,17-18H,2-3,8-13H2,1H3,(H,21,24)/t17-,18+/m0/s1
InChIKeyILIJENYIOCCQBK-ZWKOTPCHSA-N
MW363.43 g/mol
LogP1.33
Rot. Bonds4

About N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide

N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide (PubChem CID 124831920) has the molecular formula C19H26FN3O3 and a molecular weight of 363.43 g/mol. Its IUPAC name is N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide
PubChem CID124831920
Molecular FormulaC19H26FN3O3
Molecular Weight363.43 g/mol
Exact Mass363.20
IUPAC NameN-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide
SMILESCC(=O)N[C@H]1CCCN(C(=O)CN2CCO[C@@H](c3ccc(F)cc3)C2)C1
InChIInChI=1S/C19H26FN3O3/c1-14(24)21-17-3-2-8-23(11-17)19(25)13-22-9-10-26-18(12-22)15-4-6-16(20)7-5-15/h4-7,17-18H,2-3,8-13H2,1H3,(H,21,24)/t17-,18+/m0/s1
InChIKeyILIJENYIOCCQBK-ZWKOTPCHSA-N
XLogP1.33
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.43
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3R)-1-[2-[(3R)-3-(4-fluorophenyl)pyrrolidin-1-yl]acetyl]piperidin-3-yl]acetamide
CID 97098448
2-[2-(4-fluorophenyl)morpholin-4-yl]-N-(2-methylcyclohexyl)acetamide
CID 42949577
1-(azetidin-1-yl)-2-[2-(4-bromophenyl)morpholin-4-yl]ethanone
CID 71937098
1-(azepan-1-yl)-2-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]ethanone
CID 138994235
N-(4-acetylphenyl)-2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetamide
CID 36737265
N-[(3S)-1-(2-morpholin-4-yl-2-oxoethyl)piperidin-3-yl]acetamide
CID 97312328
3-[2-(4-fluorophenyl)morpholin-4-yl]-3-oxopropanoic acid
CID 62231452
N-[1-[2-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]acetyl]piperidin-3-yl]acetamide
CID 120761183
2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 94823425
1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 124618373
3-(cyclopropylamino)-1-[2-(4-fluorophenyl)morpholin-4-yl]propan-1-one
CID 60964272
N-[1-[2-(4-aminopiperidin-1-yl)acetyl]piperidin-3-yl]acetamide;hydrochloride
CID 119908203

Frequently Asked Questions

What is the IUPAC name of N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide?
The IUPAC name of N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide (CID 124831920) is N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide.
What is the SMILES notation for N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide?
The canonical SMILES for N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide is CC(=O)N[C@H]1CCCN(C(=O)CN2CCO[C@@H](c3ccc(F)cc3)C2)C1.
What is the InChIKey of N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide?
The InChIKey is ILIJENYIOCCQBK-ZWKOTPCHSA-N. The full InChI is InChI=1S/C19H26FN3O3/c1-14(24)21-17-3-2-8-23(11-17)19(25)13-22-9-10-26-18(12-22)15-4-6-16(20)7-5-15/h4-7,17-18H,2-3,8-13H2,1H3,(H,21,24)/t17-,18+/m0/s1.
What are the key properties of N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide?
N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide has a molecular weight of 363.43 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-1-[2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetyl]piperidin-3-yl]acetamide is sourced from PubChem (CID 124831920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).