N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide

C16H25N3O2 — CID 78787324

IUPACN-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
SMILESCC(C)(C)NC(=O)CN1CCN(c2ccc(O)cc2)CC1
InChIInChI=1S/C16H25N3O2/c1-16(2,3)17-15(21)12-18-8-10-19(11-9-18)13-4-6-14(20)7-5-13/h4-7,20H,8-12H2,1-3H3,(H,17,21)
InChIKeyPCARZKOCFMJPKC-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.43
Rot. Bonds3

About N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide

N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide (PubChem CID 78787324) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
PubChem CID78787324
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
SMILESCC(C)(C)NC(=O)CN1CCN(c2ccc(O)cc2)CC1
InChIInChI=1S/C16H25N3O2/c1-16(2,3)17-15(21)12-18-8-10-19(11-9-18)13-4-6-14(20)7-5-13/h4-7,20H,8-12H2,1-3H3,(H,17,21)
InChIKeyPCARZKOCFMJPKC-UHFFFAOYSA-N
XLogP1.43
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-cyano-3-methylbutan-2-yl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 78611022
N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8690332
2-[4-[2-(tert-butylamino)-2-oxoethyl]-7-(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid
CID 155097087
N-(3-chloro-4-methylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8690802
2-[4-[2-(tert-butylamino)-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;yttrium
CID 59282721
N-(4-bromo-3-methylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8690820
N-(3-ethylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8691104
N-(2-fluoro-4-methylphenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8691168
2-(azepan-1-yl)-N-tert-butylacetamide
CID 18877375
2-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-(4-methyl-2-nitrophenyl)acetamide
CID 29325726
N-tert-butyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 51194247
N-tert-butyl-2-(4-oxopiperidin-1-yl)acetamide
CID 24704213

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide (CID 78787324) is N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide is CC(C)(C)NC(=O)CN1CCN(c2ccc(O)cc2)CC1.
What is the InChIKey of N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide?
The InChIKey is PCARZKOCFMJPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-16(2,3)17-15(21)12-18-8-10-19(11-9-18)13-4-6-14(20)7-5-13/h4-7,20H,8-12H2,1-3H3,(H,17,21).
What are the key properties of N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide?
N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide has a molecular weight of 291.39 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 78787324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).