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

C17H32N4O3 — CID 26518929

IUPACN-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide
SMILESCC(C)(C)NC(=O)CN1CCN(C(=O)CN2CCC(O)CC2)CC1
InChIInChI=1S/C17H32N4O3/c1-17(2,3)18-15(23)12-20-8-10-21(11-9-20)16(24)13-19-6-4-14(22)5-7-19/h14,22H,4-13H2,1-3H3,(H,18,23)
InChIKeyBZQRAFOVQDCAAE-UHFFFAOYSA-N
MW340.47 g/mol
LogP-0.50
Rot. Bonds4

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

N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide (PubChem CID 26518929) has the molecular formula C17H32N4O3 and a molecular weight of 340.47 g/mol. Its IUPAC name is N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide
PubChem CID26518929
Molecular FormulaC17H32N4O3
Molecular Weight340.47 g/mol
Exact Mass340.25
IUPAC NameN-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide
SMILESCC(C)(C)NC(=O)CN1CCN(C(=O)CN2CCC(O)CC2)CC1
InChIInChI=1S/C17H32N4O3/c1-17(2,3)18-15(23)12-20-8-10-21(11-9-20)16(24)13-19-6-4-14(22)5-7-19/h14,22H,4-13H2,1-3H3,(H,18,23)
InChIKeyBZQRAFOVQDCAAE-UHFFFAOYSA-N
XLogP-0.50
TPSA76.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-tert-butylacetamide
CID 78808255
1-[2-[4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl]-2-oxoethyl]piperidine-3-carboxylic acid
CID 120679249
1-[2-[4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl]-2-oxoethyl]pyrrolidine-2-carboxylic acid
CID 119908851
2-(4-hydroxypiperidin-1-yl)-1-(4-prop-2-ynylpiperazin-1-yl)ethanone
CID 111544194
2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride
CID 56773517
2-[4-[2-(tert-butylamino)-2-oxoethyl]-7-(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid
CID 155097087
N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
CID 30641335
N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide
CID 121184695
2-[4-[2-(tert-butylamino)-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;yttrium
CID 59282721
2-(azepan-1-yl)-N-tert-butylacetamide
CID 18877375
2-[(3S)-3-aminopyrrolidin-1-yl]-N-tert-butylacetamide
CID 81492142
2-[4-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]acetyl]-1,4-diazepan-1-yl]-N-tert-butylacetamide
CID 98684839

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide?
The IUPAC name of N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide (CID 26518929) is N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide.
What is the SMILES notation for N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide?
The canonical SMILES for N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide is CC(C)(C)NC(=O)CN1CCN(C(=O)CN2CCC(O)CC2)CC1.
What is the InChIKey of N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide?
The InChIKey is BZQRAFOVQDCAAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4O3/c1-17(2,3)18-15(23)12-20-8-10-21(11-9-20)16(24)13-19-6-4-14(22)5-7-19/h14,22H,4-13H2,1-3H3,(H,18,23).
What are the key properties of N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide?
N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide has a molecular weight of 340.47 g/mol, XLogP of -0.50, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[4-[2-(4-hydroxypiperidin-1-yl)acetyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 26518929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).