N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide

C15H23ClN2O — CID 8767576

IUPACN-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide
SMILESC[C@H](c1ccccc1Cl)N(C)CC(=O)NC(C)(C)C
InChIInChI=1S/C15H23ClN2O/c1-11(12-8-6-7-9-13(12)16)18(5)10-14(19)17-15(2,3)4/h6-9,11H,10H2,1-5H3,(H,17,19)/t11-/m1/s1
InChIKeyDOBGTEHHLKVCTI-LLVKDONJSA-N
MW282.81 g/mol
LogP3.25
Rot. Bonds4

About N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide

N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide (PubChem CID 8767576) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide
PubChem CID8767576
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide
SMILESC[C@H](c1ccccc1Cl)N(C)CC(=O)NC(C)(C)C
InChIInChI=1S/C15H23ClN2O/c1-11(12-8-6-7-9-13(12)16)18(5)10-14(19)17-15(2,3)4/h6-9,11H,10H2,1-5H3,(H,17,19)/t11-/m1/s1
InChIKeyDOBGTEHHLKVCTI-LLVKDONJSA-N
XLogP3.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-[1-(2-chlorophenyl)ethyl-methylamino]acetamide
CID 84831983
2-[1-(2-chlorophenyl)ethyl-methylamino]-N-ethylacetamide
CID 60505315
2-[[(1S)-1-(2-chlorophenyl)ethyl]-methylamino]-N-(4-fluorophenyl)acetamide
CID 9253059
N-tert-butyl-2-[[2-[1-(2,4-dichlorophenyl)ethyl-methylamino]acetyl]-methylamino]acetamide
CID 55568921
N-tert-butyl-3-[1-(2-chlorophenyl)ethylamino]propanamide
CID 112688495
2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 9287667
1-[1-(2-chlorophenyl)ethyl-methylamino]-2-methylpropan-2-ol
CID 62978499
2-[1-(2-chlorophenyl)ethyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 51282265
2-[1-(2-chlorophenyl)ethyl-methylamino]-N-methyl-N-phenylacetamide
CID 60505511
N-tert-butyl-2-[(2-chlorophenyl)methyl-methylamino]acetamide
CID 8756656
N-tert-butyl-2-[methyl-[2-[methyl(1-phenylethyl)amino]acetyl]amino]acetamide
CID 51226996
2-[1-(2-chlorophenyl)ethyl-methylamino]-1-(2-methylphenyl)ethanone
CID 62980408

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide?
The IUPAC name of N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide (CID 8767576) is N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide?
The canonical SMILES for N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide is C[C@H](c1ccccc1Cl)N(C)CC(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide?
The InChIKey is DOBGTEHHLKVCTI-LLVKDONJSA-N. The full InChI is InChI=1S/C15H23ClN2O/c1-11(12-8-6-7-9-13(12)16)18(5)10-14(19)17-15(2,3)4/h6-9,11H,10H2,1-5H3,(H,17,19)/t11-/m1/s1.
What are the key properties of N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide?
N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide has a molecular weight of 282.81 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]-methylamino]acetamide is sourced from PubChem (CID 8767576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).