2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride

C13H28ClN3O — CID 119908436

IUPAC2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride
SMILESCC(C)(C)CCNC(=O)CN1CCC(N)CC1.Cl
InChIInChI=1S/C13H27N3O.ClH/c1-13(2,3)6-7-15-12(17)10-16-8-4-11(14)5-9-16;/h11H,4-10,14H2,1-3H3,(H,15,17);1H
InChIKeyBUIVOOPJGICJOQ-UHFFFAOYSA-N
MW277.84 g/mol
LogP1.38
Rot. Bonds4

About 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride

2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride (PubChem CID 119908436) has the molecular formula C13H28ClN3O and a molecular weight of 277.84 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride
PubChem CID119908436
Molecular FormulaC13H28ClN3O
Molecular Weight277.84 g/mol
Exact Mass277.19
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride
SMILESCC(C)(C)CCNC(=O)CN1CCC(N)CC1.Cl
InChIInChI=1S/C13H27N3O.ClH/c1-13(2,3)6-7-15-12(17)10-16-8-4-11(14)5-9-16;/h11H,4-10,14H2,1-3H3,(H,15,17);1H
InChIKeyBUIVOOPJGICJOQ-UHFFFAOYSA-N
XLogP1.38
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.84
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-(3,3,3-trifluoropropyl)acetamide
CID 79327739
2-(4-aminopiperidin-1-yl)-N-tert-butylacetamide;dihydrochloride
CID 56773517
2-(4-aminopiperidin-1-yl)-N-[(2R)-2-hydroxypropyl]acetamide
CID 107220866
2-(4-aminopiperidin-1-yl)-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 79332156
2-(4-aminopiperidin-1-yl)-N-pent-3-ynylacetamide
CID 116644130
2-(4-aminopiperidin-1-yl)-N-(2,3-dihydroxy-2-methylpropyl)acetamide
CID 79328199
2-(4-aminopiperidin-1-yl)-N-(3-methylsulfanylpropyl)acetamide
CID 79328495
2-(4-aminopiperidin-1-yl)-N-[2-[ethyl(methyl)amino]ethyl]acetamide
CID 79328337
2-(4-aminopiperidin-1-yl)-N-(2-propan-2-yloxyethyl)acetamide
CID 113450216
2-(4-aminopiperidin-1-yl)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 82724240
2-(4-aminopiperidin-1-yl)-N-(2-ethyl-2-hydroxybutyl)acetamide
CID 79327517
2-(4-aminopiperidin-1-yl)-N-[3-(2-methoxyethoxy)propyl]acetamide
CID 79327489

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride (CID 119908436) is 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride is CC(C)(C)CCNC(=O)CN1CCC(N)CC1.Cl.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride?
The InChIKey is BUIVOOPJGICJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O.ClH/c1-13(2,3)6-7-15-12(17)10-16-8-4-11(14)5-9-16;/h11H,4-10,14H2,1-3H3,(H,15,17);1H.
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride?
2-(4-aminopiperidin-1-yl)-N-(3,3-dimethylbutyl)acetamide;hydrochloride has a molecular weight of 277.84 g/mol, XLogP of 1.38, 4 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-(3,3-dimethylbutyl)acetamide;hydrochloride is sourced from PubChem (CID 119908436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).