2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide

C16H33N3O — CID 63849748

IUPAC2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CN1CCCCC1CNC(C)(C)C
InChIInChI=1S/C16H33N3O/c1-6-18(7-2)15(20)13-19-11-9-8-10-14(19)12-17-16(3,4)5/h14,17H,6-13H2,1-5H3
InChIKeyRGMYJPPSLZASMA-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.10
Rot. Bonds6

About 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide

2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide (PubChem CID 63849748) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide.

Molecular Properties

Compound Name2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide
PubChem CID63849748
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CN1CCCCC1CNC(C)(C)C
InChIInChI=1S/C16H33N3O/c1-6-18(7-2)15(20)13-19-11-9-8-10-14(19)12-17-16(3,4)5/h14,17H,6-13H2,1-5H3
InChIKeyRGMYJPPSLZASMA-UHFFFAOYSA-N
XLogP2.10
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N-ethyl-N-methylacetamide
CID 55256274
N,N-diethyl-2-[(2S)-2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]acetamide
CID 95261573
2-[2-(aminomethyl)piperidin-1-yl]-N,N-diethylacetamide;hydrochloride
CID 120869605
N,N-diethyl-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 62733674
N-[[1-(ethoxymethyl)piperidin-2-yl]methyl]-2-methylpropan-2-amine
CID 65366916
N,N-diethyl-2-[2-(2-oxopropyl)pyrrolidin-1-yl]acetamide
CID 79546901
2-methyl-N-[[1-(2-methylbutyl)piperidin-2-yl]methyl]propan-2-amine
CID 62580952
N-cyclopropyl-N-ethyl-2-[2-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63250442
1-[2-(diethylamino)-2-oxoethyl]piperidine-2-carboxylic acid
CID 43441021
methyl 1-[2-(diethylamino)-2-oxoethyl]piperidine-2-carboxylate
CID 115279176
N,N-dimethyl-2-[2-(propylaminomethyl)piperidin-1-yl]acetamide
CID 63847147
2-[2-[(tert-butylamino)methyl]piperidin-1-yl]butanamide
CID 55256655

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide?
The IUPAC name of 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide (CID 63849748) is 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide.
What is the SMILES notation for 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide?
The canonical SMILES for 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide is CCN(CC)C(=O)CN1CCCCC1CNC(C)(C)C.
What is the InChIKey of 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide?
The InChIKey is RGMYJPPSLZASMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-6-18(7-2)15(20)13-19-11-9-8-10-14(19)12-17-16(3,4)5/h14,17H,6-13H2,1-5H3.
What are the key properties of 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide?
2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide has a molecular weight of 283.46 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(tert-butylamino)methyl]piperidin-1-yl]-N,N-diethylacetamide is sourced from PubChem (CID 63849748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).