2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride

C11H25Cl2N3O — CID 56773517

IUPAC2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride
SMILESCC(C)(C)NC(=O)CN1CCC(N)CC1.Cl.Cl
InChIInChI=1S/C11H23N3O.2ClH/c1-11(2,3)13-10(15)8-14-6-4-9(12)5-7-14;;/h9H,4-8,12H2,1-3H3,(H,13,15);2*1H
InChIKeyNHWTWBQPQOEBPP-UHFFFAOYSA-N
MW286.25 g/mol
LogP1.17
Rot. Bonds2

About 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride

2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride (PubChem CID 56773517) has the molecular formula C11H25Cl2N3O and a molecular weight of 286.25 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride
PubChem CID56773517
Molecular FormulaC11H25Cl2N3O
Molecular Weight286.25 g/mol
Exact Mass285.14
IUPAC Name2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride
SMILESCC(C)(C)NC(=O)CN1CCC(N)CC1.Cl.Cl
InChIInChI=1S/C11H23N3O.2ClH/c1-11(2,3)13-10(15)8-14-6-4-9(12)5-7-14;;/h9H,4-8,12H2,1-3H3,(H,13,15);2*1H
InChIKeyNHWTWBQPQOEBPP-UHFFFAOYSA-N
XLogP1.17
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.25
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3S)-3-aminopyrrolidin-1-yl]-N-tert-butylacetamide
CID 81492142
2-(4-aminopiperidin-1-yl)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82724240
2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride
CID 119908436
N-tert-butyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119922204
2-(azepan-1-yl)-N-tert-butylacetamide
CID 18877375
2-[4-(2-aminoethoxy)piperidin-1-yl]-N-tert-butylacetamide
CID 82693750
N-tert-butyl-2-[4-[(2-methylpropylamino)methyl]piperidin-1-yl]acetamide
CID 63848272
2-[4-[2-(tert-butylamino)-2-oxoethyl]-7-(carboxymethyl)-1,4,7-triazonan-1-yl]acetic acid
CID 155097087
N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)acetamide
CID 121184695
2-[4-[[[amino-(propan-2-ylamino)methylidene]amino]methyl]piperidin-1-yl]-N-tert-butylacetamide
CID 111859795
2-[3-(aminomethyl)piperidin-1-yl]-N-tert-butylacetamide
CID 43186946
2-(4-aminopiperidin-1-yl)-N-(2,3-dihydroxy-2-methylpropyl)acetamide
CID 79328199

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride (CID 56773517) is 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride is CC(C)(C)NC(=O)CN1CCC(N)CC1.Cl.Cl.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride?
The InChIKey is NHWTWBQPQOEBPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O.2ClH/c1-11(2,3)13-10(15)8-14-6-4-9(12)5-7-14;;/h9H,4-8,12H2,1-3H3,(H,13,15);2*1H.
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride?
2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride has a molecular weight of 286.25 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride is sourced from PubChem (CID 56773517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).