2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide

C14H21N3O3 — CID 60992391

IUPAC2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide
SMILESCOc1cc(C(C)(C(N)=O)N2CCNCC2)ccc1O
InChIInChI=1S/C14H21N3O3/c1-14(13(15)19,17-7-5-16-6-8-17)10-3-4-11(18)12(9-10)20-2/h3-4,9,16,18H,5-8H2,1-2H3,(H2,15,19)
InChIKeyQIGLXKAYBZFBKR-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.01
Rot. Bonds4

About 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide

2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide (PubChem CID 60992391) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound Name2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide
PubChem CID60992391
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide
SMILESCOc1cc(C(C)(C(N)=O)N2CCNCC2)ccc1O
InChIInChI=1S/C14H21N3O3/c1-14(13(15)19,17-7-5-16-6-8-17)10-3-4-11(18)12(9-10)20-2/h3-4,9,16,18H,5-8H2,1-2H3,(H2,15,19)
InChIKeyQIGLXKAYBZFBKR-UHFFFAOYSA-N
XLogP0.01
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-hydroxy-3-methoxyphenyl)-2-morpholin-4-ylpropanoic acid
CID 43803253
2-methoxy-4-(2-methyl-1-piperazin-1-ylpropan-2-yl)phenol
CID 116987599
2-(4-ethoxyphenyl)-2-piperazin-1-ylpropanamide
CID 60992132
2-(1,3-benzodioxol-5-yl)-2-(1,4-diazepan-1-yl)propanamide
CID 60997169
2-methoxy-4-(2-methyl-2-piperazin-1-ylpropyl)phenol
CID 116987601
2-methoxy-4-[2,3,3-tris(4-hydroxy-3-methoxyphenyl)butan-2-yl]phenol
CID 141133714
2-methoxy-4-piperazin-1-ylphenol
CID 24820540
2-(ethylamino)-2-(4-hydroxy-3-methoxyphenyl)propanamide
CID 60787205
2-(4-hydroxy-3-methoxyphenyl)-2-(propan-2-ylamino)propanamide
CID 60787348
1-[2-(3-fluoro-4-methoxyphenyl)propan-2-yl]piperazine
CID 82298206
2-(2,5-dichlorophenyl)-2-piperazin-1-ylpropanamide
CID 54891363
methyl 2-[4-(dimethylamino)phenyl]-2-piperazin-1-ylpropanoate
CID 61002598

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide?
The IUPAC name of 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide (CID 60992391) is 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide.
What is the SMILES notation for 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide?
The canonical SMILES for 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide is COc1cc(C(C)(C(N)=O)N2CCNCC2)ccc1O.
What is the InChIKey of 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide?
The InChIKey is QIGLXKAYBZFBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-14(13(15)19,17-7-5-16-6-8-17)10-3-4-11(18)12(9-10)20-2/h3-4,9,16,18H,5-8H2,1-2H3,(H2,15,19).
What are the key properties of 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide?
2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide has a molecular weight of 279.34 g/mol, XLogP of 0.01, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-3-methoxyphenyl)-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 60992391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).