N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide

C18H34N4O2 — CID 30641335

IUPACN-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
SMILESC[C@@H]1CCCCN1C(=O)CN1CCN(CC(=O)NC(C)(C)C)CC1
InChIInChI=1S/C18H34N4O2/c1-15-7-5-6-8-22(15)17(24)14-21-11-9-20(10-12-21)13-16(23)19-18(2,3)4/h15H,5-14H2,1-4H3,(H,19,23)/t15-/m1/s1
InChIKeyQBQXOYUCTWAZSA-OAHLLOKOSA-N
MW338.50 g/mol
LogP0.92
Rot. Bonds4

About N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide

N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide (PubChem CID 30641335) has the molecular formula C18H34N4O2 and a molecular weight of 338.50 g/mol. Its IUPAC name is N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
PubChem CID30641335
Molecular FormulaC18H34N4O2
Molecular Weight338.50 g/mol
Exact Mass338.27
IUPAC NameN-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
SMILESC[C@@H]1CCCCN1C(=O)CN1CCN(CC(=O)NC(C)(C)C)CC1
InChIInChI=1S/C18H34N4O2/c1-15-7-5-6-8-22(15)17(24)14-21-11-9-20(10-12-21)13-16(23)19-18(2,3)4/h15H,5-14H2,1-4H3,(H,19,23)/t15-/m1/s1
InChIKeyQBQXOYUCTWAZSA-OAHLLOKOSA-N
XLogP0.92
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

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Related Compounds

Acetamide, N-(2,2,6,6-tetramethyl-4-piperidinyl)-2-((2,2,6,6-tetramethyl-4-piperidinyl)amino)-
CID 579978
N-cyclohexyl-2-(4-cyclopentylpiperazin-1-yl)-2-methylpropanamide
CID 49853987
2-Piperazinone, 1-[2-(cyclohexylamino)ethyl]-3,3,5,5-tetramethyl-
CID 15165099
2-(4-cyclohexylpiperazin-1-yl)-2-methyl-N-propan-2-ylpropanamide
CID 49853885
N,N'-Ethylenebis-1-piperidineacetamide
CID 2920518
(6S)-1-[[1-(2-ethylbutyl)piperidin-4-yl]methyl]-6-(2-methylpropyl)piperazine-2,3-dione
CID 51359787
N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 580079
N-butan-2-yl-2-[4-(2-methylpiperidin-1-yl)sulfonylpiperazin-1-yl]acetamide
CID 42955196
(6S)-6-[(2S)-butan-2-yl]-1-[[1-(2-ethylbutyl)piperidin-4-yl]methyl]piperazine-2,3-dione
CID 45281037
N-(2-methylpropyl)-2-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]propanamide
CID 75386858
(6S)-1-[[1-(3-methylbutyl)piperidin-4-yl]methyl]-6-(2-methylpropyl)piperazine-2,3-dione
CID 51359788
2-(piperidin-1-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 566967

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide?
The IUPAC name of N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide (CID 30641335) is N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide.
What is the SMILES notation for N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide?
The canonical SMILES for N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide is C[C@@H]1CCCCN1C(=O)CN1CCN(CC(=O)NC(C)(C)C)CC1.
What is the InChIKey of N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide?
The InChIKey is QBQXOYUCTWAZSA-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H34N4O2/c1-15-7-5-6-8-22(15)17(24)14-21-11-9-20(10-12-21)13-16(23)19-18(2,3)4/h15H,5-14H2,1-4H3,(H,19,23)/t15-/m1/s1.
What are the key properties of N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide?
N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide has a molecular weight of 338.50 g/mol, XLogP of 0.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 30641335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).