2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide

C15H23N3O2 — CID 17392933

IUPAC2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide
SMILESCNC(=O)C(C)N1CCN(c2ccccc2OC)CC1
InChIInChI=1S/C15H23N3O2/c1-12(15(19)16-2)17-8-10-18(11-9-17)13-6-4-5-7-14(13)20-3/h4-7,12H,8-11H2,1-3H3,(H,16,19)
InChIKeyRVMCTLDIILESSF-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.95
Rot. Bonds4

About 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide

2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide (PubChem CID 17392933) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide.

Molecular Properties

Compound Name2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide
PubChem CID17392933
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide
SMILESCNC(=O)C(C)N1CCN(c2ccccc2OC)CC1
InChIInChI=1S/C15H23N3O2/c1-12(15(19)16-2)17-8-10-18(11-9-17)13-6-4-5-7-14(13)20-3/h4-7,12H,8-11H2,1-3H3,(H,16,19)
InChIKeyRVMCTLDIILESSF-UHFFFAOYSA-N
XLogP0.95
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 17445171
methyl 2-[4-(2-methoxyphenyl)piperazin-1-yl]propanoate
CID 47016293
(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)propanamide
CID 9249291
(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(4-phenoxyphenyl)propanamide
CID 41123999
(2R)-N-[2-(dimethylamino)ethyl]-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 92984615
N-(3-chlorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 46054199
(2S)-N-(2-acetylphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 9249385
(2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
CID 2442399
(2R)-N-(cyclopentylcarbamoyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 9249455
(2S)-N-(benzylcarbamoyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 9249441
(2R)-N-[(3R)-1,1-dioxothiolan-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-yl]propanamide
CID 9249253
(2S)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(1,3-thiazol-2-yl)propanamide
CID 40932948

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide?
The IUPAC name of 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide (CID 17392933) is 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide.
What is the SMILES notation for 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide?
The canonical SMILES for 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide is CNC(=O)C(C)N1CCN(c2ccccc2OC)CC1.
What is the InChIKey of 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide?
The InChIKey is RVMCTLDIILESSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12(15(19)16-2)17-8-10-18(11-9-17)13-6-4-5-7-14(13)20-3/h4-7,12H,8-11H2,1-3H3,(H,16,19).
What are the key properties of 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide?
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide has a molecular weight of 277.37 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-methylpropanamide is sourced from PubChem (CID 17392933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).