N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide

C14H22N4O — CID 115377065

IUPACN-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide
SMILESCN(C)c1cccc(NC(=O)CN2CCNCC2)c1
InChIInChI=1S/C14H22N4O/c1-17(2)13-5-3-4-12(10-13)16-14(19)11-18-8-6-15-7-9-18/h3-5,10,15H,6-9,11H2,1-2H3,(H,16,19)
InChIKeyZGSQYGPDYMKFKM-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.60
Rot. Bonds4

About N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide

N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide (PubChem CID 115377065) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide
PubChem CID115377065
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide
SMILESCN(C)c1cccc(NC(=O)CN2CCNCC2)c1
InChIInChI=1S/C14H22N4O/c1-17(2)13-5-3-4-12(10-13)16-14(19)11-18-8-6-15-7-9-18/h3-5,10,15H,6-9,11H2,1-2H3,(H,16,19)
InChIKeyZGSQYGPDYMKFKM-UHFFFAOYSA-N
XLogP0.60
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylamino)phenyl]-2-morpholin-4-ylacetamide
CID 110483400
2-piperazin-1-yl-N-(3-propan-2-ylphenyl)acetamide
CID 29009163
2-piperazin-1-yl-N-[3-(1,2,4-triazol-4-yl)phenyl]acetamide
CID 60851422
2-[3-[(2-piperazin-1-ylacetyl)amino]phenyl]acetic acid
CID 65350381
2-piperazin-1-yl-N-(3-propoxyphenyl)acetamide
CID 60851959
2-(1,4-diazepan-1-yl)-N-(3-propan-2-ylphenyl)acetamide
CID 43348732
2-(1,4-diazepan-1-yl)-N-[3-(hydroxymethyl)phenyl]acetamide
CID 62838993
3-[[2-(1,4-diazepan-1-yl)acetyl]amino]benzamide
CID 62839609
2-(1,4-diazepan-1-yl)-N-[3-(dimethylamino)-4-methylphenyl]acetamide
CID 115377407
N-(3,4-dimethylphenyl)-2-piperazin-1-ylacetamide;hydrochloride
CID 132965081
2-(1,4-diazepan-1-yl)-N-(3-ethoxyphenyl)acetamide
CID 62838844
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-piperazin-1-ylacetamide
CID 60851602

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide?
The IUPAC name of N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide (CID 115377065) is N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide?
The canonical SMILES for N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide is CN(C)c1cccc(NC(=O)CN2CCNCC2)c1.
What is the InChIKey of N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide?
The InChIKey is ZGSQYGPDYMKFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-17(2)13-5-3-4-12(10-13)16-14(19)11-18-8-6-15-7-9-18/h3-5,10,15H,6-9,11H2,1-2H3,(H,16,19).
What are the key properties of N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide?
N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide has a molecular weight of 262.36 g/mol, XLogP of 0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide is sourced from PubChem (CID 115377065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).