N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide

C19H22FN3O2 — CID 2264834

IUPACN-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide
SMILESCOc1ccccc1N1CCN(CC(=O)Nc2cccc(F)c2)CC1
InChIInChI=1S/C19H22FN3O2/c1-25-18-8-3-2-7-17(18)23-11-9-22(10-12-23)14-19(24)21-16-6-4-5-15(20)13-16/h2-8,13H,9-12,14H2,1H3,(H,21,24)
InChIKeyNNGCBYKACOXOTD-UHFFFAOYSA-N
MW343.40 g/mol
LogP2.60
Rot. Bonds5

About N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide

N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide (PubChem CID 2264834) has the molecular formula C19H22FN3O2 and a molecular weight of 343.40 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide
PubChem CID2264834
Molecular FormulaC19H22FN3O2
Molecular Weight343.40 g/mol
Exact Mass343.17
IUPAC NameN-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide
SMILESCOc1ccccc1N1CCN(CC(=O)Nc2cccc(F)c2)CC1
InChIInChI=1S/C19H22FN3O2/c1-25-18-8-3-2-7-17(18)23-11-9-22(10-12-23)14-19(24)21-16-6-4-5-15(20)13-16/h2-8,13H,9-12,14H2,1H3,(H,21,24)
InChIKeyNNGCBYKACOXOTD-UHFFFAOYSA-N
XLogP2.60
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.40
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Urapidil
CID 5639
1-(2-Methoxyphenyl)piperazine
CID 1346
Acetamide, N-(2-methoxyphenyl)-
CID 7135
5-Methylurapidil
CID 5640
N-(2-Methoxyphenyl)piperazine hydrochloride
CID 9899402
Urapidil hydrochloride
CID 167980
LR 511
CID 68696
1-(2-Ethoxyphenyl)piperazine
CID 83357
1-[2-(Propan-2-yloxy)phenyl]piperazine
CID 10944016
Rwj-69736
CID 9866614
1-(2-Methoxyphenyl)-4-propylpiperazine
CID 410747
Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-
CID 55421

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide (CID 2264834) is N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide is COc1ccccc1N1CCN(CC(=O)Nc2cccc(F)c2)CC1.
What is the InChIKey of N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide?
The InChIKey is NNGCBYKACOXOTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O2/c1-25-18-8-3-2-7-17(18)23-11-9-22(10-12-23)14-19(24)21-16-6-4-5-15(20)13-16/h2-8,13H,9-12,14H2,1H3,(H,21,24).
What are the key properties of N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide?
N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide has a molecular weight of 343.40 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 2264834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).