(2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide

C18H25FN4O3 — CID 26040439

IUPAC(2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide
SMILESNC(=O)[C@H](c1ccc(F)cc1)N1CCN(C(=O)CN2CCOCC2)CC1
InChIInChI=1S/C18H25FN4O3/c19-15-3-1-14(2-4-15)17(18(20)25)23-7-5-22(6-8-23)16(24)13-21-9-11-26-12-10-21/h1-4,17H,5-13H2,(H2,20,25)/t17-/m0/s1
InChIKeyJUZFSCLJSDVTGK-KRWDZBQOSA-N
MW364.42 g/mol
LogP-0.17
Rot. Bonds5

About (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide

(2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide (PubChem CID 26040439) has the molecular formula C18H25FN4O3 and a molecular weight of 364.42 g/mol. Its IUPAC name is (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound Name(2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide
PubChem CID26040439
Molecular FormulaC18H25FN4O3
Molecular Weight364.42 g/mol
Exact Mass364.19
IUPAC Name(2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide
SMILESNC(=O)[C@H](c1ccc(F)cc1)N1CCN(C(=O)CN2CCOCC2)CC1
InChIInChI=1S/C18H25FN4O3/c19-15-3-1-14(2-4-15)17(18(20)25)23-7-5-22(6-8-23)16(24)13-21-9-11-26-12-10-21/h1-4,17H,5-13H2,(H2,20,25)/t17-/m0/s1
InChIKeyJUZFSCLJSDVTGK-KRWDZBQOSA-N
XLogP-0.17
TPSA79.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]-2-phenylacetamide
CID 51075038
1-[4-(4-fluorophenyl)piperazin-1-yl]-2-morpholin-4-ylethanone
CID 110688043
2-(4-fluorophenyl)-2-pyrrolidin-1-ylacetamide
CID 82114619
N,N-diethyl-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]-2-phenylacetamide
CID 55498439
2-(4-benzoylpiperazin-1-yl)-2-(4-fluorophenyl)acetamide
CID 69403152
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-morpholin-4-ylacetamide
CID 2534176
2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-2-phenyl-1-piperidin-1-ylethanone
CID 55412944
(2S)-2-(4-chlorophenyl)-2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]acetamide
CID 97261025
3-amino-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]-3-phenylpropan-1-one
CID 119952905
(2R)-2-(4-fluorophenyl)-2-[4-[(2R)-2-hydroxy-3,3-dimethylbutyl]piperazin-1-yl]acetamide
CID 95309214
2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]-1-morpholin-4-ylethanone
CID 81348384
1-[4-[2-(2,4-difluorophenoxy)acetyl]piperazin-1-yl]-2-morpholin-4-ylethanone
CID 55596207

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide?
The IUPAC name of (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide (CID 26040439) is (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide.
What is the SMILES notation for (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide?
The canonical SMILES for (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide is NC(=O)[C@H](c1ccc(F)cc1)N1CCN(C(=O)CN2CCOCC2)CC1.
What is the InChIKey of (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide?
The InChIKey is JUZFSCLJSDVTGK-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H25FN4O3/c19-15-3-1-14(2-4-15)17(18(20)25)23-7-5-22(6-8-23)16(24)13-21-9-11-26-12-10-21/h1-4,17H,5-13H2,(H2,20,25)/t17-/m0/s1.
What are the key properties of (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide?
(2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide has a molecular weight of 364.42 g/mol, XLogP of -0.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-fluorophenyl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 26040439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).