N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide

C16H25N3O2 — CID 34773711

IUPACN-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCN(C(C)C)CC1
InChIInChI=1S/C16H25N3O2/c1-13(2)19-10-8-18(9-11-19)12-16(20)17-14-6-4-5-7-15(14)21-3/h4-7,13H,8-12H2,1-3H3,(H,17,20)
InChIKeyGWZHSVXBDIBONX-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.66
Rot. Bonds5

About N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide

N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide (PubChem CID 34773711) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide
PubChem CID34773711
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCN(C(C)C)CC1
InChIInChI=1S/C16H25N3O2/c1-13(2)19-10-8-18(9-11-19)12-16(20)17-14-6-4-5-7-15(14)21-3/h4-7,13H,8-12H2,1-3H3,(H,17,20)
InChIKeyGWZHSVXBDIBONX-UHFFFAOYSA-N
XLogP1.66
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethylphenyl)-2-[4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 9436558
N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide
CID 17185460
2-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 33070046
N-(2-methoxyphenyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide
CID 8745789
2-[4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-methoxyphenyl)propanamide
CID 46820727
N-(2-methoxyphenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922615
2-[4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl]-N-(4-sulfamoylphenyl)acetamide
CID 20970585
tert-butyl 4-[2-(2-methoxyanilino)-2-oxoethyl]-1,4-diazepane-1-carboxylate
CID 166605682
2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 8930541
2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 3241108
2-[(3S)-3-hydroxypiperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 31478295
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-(2-methoxyphenyl)acetamide
CID 22194042

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide (CID 34773711) is N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide is COc1ccccc1NC(=O)CN1CCN(C(C)C)CC1.
What is the InChIKey of N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide?
The InChIKey is GWZHSVXBDIBONX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-13(2)19-10-8-18(9-11-19)12-16(20)17-14-6-4-5-7-15(14)21-3/h4-7,13H,8-12H2,1-3H3,(H,17,20).
What are the key properties of N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide?
N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide has a molecular weight of 291.39 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 34773711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).