2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide

C16H27N3O2 — CID 79788538

IUPAC2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)COc1ccc(CNC(C)(C)C)nc1
InChIInChI=1S/C16H27N3O2/c1-6-19(7-2)15(20)12-21-14-9-8-13(17-11-14)10-18-16(3,4)5/h8-9,11,18H,6-7,10,12H2,1-5H3
InChIKeyVAMIRSPQQYLHAP-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.22
Rot. Bonds7

About 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide

2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide (PubChem CID 79788538) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide.

Molecular Properties

Compound Name2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide
PubChem CID79788538
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)COc1ccc(CNC(C)(C)C)nc1
InChIInChI=1S/C16H27N3O2/c1-6-19(7-2)15(20)12-21-14-9-8-13(17-11-14)10-18-16(3,4)5/h8-9,11,18H,6-7,10,12H2,1-5H3
InChIKeyVAMIRSPQQYLHAP-UHFFFAOYSA-N
XLogP2.22
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[5-(2-chloroprop-2-enoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 79784061
N,N-dimethyl-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide
CID 79776398
3-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N-ethylpropanamide
CID 79784063
3-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxymethyl]pentan-3-ol
CID 114492175
N,N-diethyl-2-[(6-formyl-3-pyridinyl)oxy]acetamide
CID 79794503
N-[[5-(3-ethylsulfonylpropoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 79788512
N-[[5-(2-ethylbutoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 82927537
N,N-diethyl-2-[4-(ethylaminomethyl)phenoxy]acetamide
CID 43276989
N-[[5-(4-methoxybutoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 104647123
2-methyl-N-[[5-(2,2,2-trifluoroethoxymethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 106704714
1-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-2,3-dimethylbutan-2-ol
CID 114492176
N,N-diethyl-2-[4-(methylamino)phenoxy]acetamide
CID 54908693

Frequently Asked Questions

What is the IUPAC name of 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide?
The IUPAC name of 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide (CID 79788538) is 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide.
What is the SMILES notation for 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide?
The canonical SMILES for 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide is CCN(CC)C(=O)COc1ccc(CNC(C)(C)C)nc1.
What is the InChIKey of 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide?
The InChIKey is VAMIRSPQQYLHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-6-19(7-2)15(20)12-21-14-9-8-13(17-11-14)10-18-16(3,4)5/h8-9,11,18H,6-7,10,12H2,1-5H3.
What are the key properties of 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide?
2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide has a molecular weight of 293.41 g/mol, XLogP of 2.22, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N,N-diethylacetamide is sourced from PubChem (CID 79788538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).