N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide

C15H29N3O — CID 121184695

IUPACN-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide
SMILESCC(C)(C)NC(=O)CN1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H29N3O/c1-15(2,3)16-14(19)12-17-8-10-18(11-9-17)13-6-4-5-7-13/h13H,4-12H2,1-3H3,(H,16,19)
InChIKeyPXHZYVTVZMFOHM-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.46
Rot. Bonds3

About N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide

N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide (PubChem CID 121184695) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide
PubChem CID121184695
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide
SMILESCC(C)(C)NC(=O)CN1CCN(C2CCCC2)CC1
InChIInChI=1S/C15H29N3O/c1-15(2,3)16-14(19)12-17-8-10-18(11-9-17)13-6-4-5-7-13/h13H,4-12H2,1-3H3,(H,16,19)
InChIKeyPXHZYVTVZMFOHM-UHFFFAOYSA-N
XLogP1.46
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azepan-1-yl)-N-tert-butylacetamide
CID 18877375
N-[(1R,2S)-2-tert-butylcyclohexyl]-2-(4-cyclohexylpiperazin-1-yl)acetamide
CID 51624821
2-[4-[2-(tert-butylamino)-2-oxoethyl]-7-(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid
CID 155097087
N-(2-acetamidoethyl)-2-(4-cyclopentylpiperazin-1-yl)acetamide
CID 34423586
N-tert-butyl-2-[4-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
CID 30641335
2-(4-cyclopentylpiperazin-1-yl)-N-(2-hydroxyethyl)acetamide
CID 62369296
2-[4-[2-(tert-butylamino)-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;yttrium
CID 59282721
2-[4-[2-(tert-butylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-N-[(1R,2R)-2-methylcyclohexyl]acetamide
CID 9131221
2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride
CID 56773517
N-tert-butyl-2-[4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylideneimidazol-1-yl)methyl]piperazin-1-yl]acetamide
CID 9279822
N-tert-butyl-2-[4-(2-oxo-1-propan-2-ylpiperidin-3-yl)piperazin-1-yl]acetamide
CID 75468309
2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-tert-butylacetamide
CID 78808255

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide?
The IUPAC name of N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide (CID 121184695) is N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide?
The canonical SMILES for N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide is CC(C)(C)NC(=O)CN1CCN(C2CCCC2)CC1.
What is the InChIKey of N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide?
The InChIKey is PXHZYVTVZMFOHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-15(2,3)16-14(19)12-17-8-10-18(11-9-17)13-6-4-5-7-13/h13H,4-12H2,1-3H3,(H,16,19).
What are the key properties of N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide?
N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide has a molecular weight of 267.42 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide is sourced from PubChem (CID 121184695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).