2-(2-amino-2-methylpropoxy)-N-benzylacetamide

C13H20N2O2 — CID 64537589

IUPAC2-(2-amino-2-methylpropoxy)-N-benzylacetamide
SMILESCC(C)(N)COCC(=O)NCc1ccccc1
InChIInChI=1S/C13H20N2O2/c1-13(2,14)10-17-9-12(16)15-8-11-6-4-3-5-7-11/h3-7H,8-10,14H2,1-2H3,(H,15,16)
InChIKeyVKYWKCZYUVAIJY-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.06
Rot. Bonds6

About 2-(2-amino-2-methylpropoxy)-N-benzylacetamide

2-(2-amino-2-methylpropoxy)-N-benzylacetamide (PubChem CID 64537589) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(2-amino-2-methylpropoxy)-N-benzylacetamide.

Molecular Properties

Compound Name2-(2-amino-2-methylpropoxy)-N-benzylacetamide
PubChem CID64537589
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(2-amino-2-methylpropoxy)-N-benzylacetamide
SMILESCC(C)(N)COCC(=O)NCc1ccccc1
InChIInChI=1S/C13H20N2O2/c1-13(2,14)10-17-9-12(16)15-8-11-6-4-3-5-7-11/h3-7H,8-10,14H2,1-2H3,(H,15,16)
InChIKeyVKYWKCZYUVAIJY-UHFFFAOYSA-N
XLogP1.06
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[2-(benzylamino)-2-oxoethoxy]acetamide
CID 2322352
2-(2-amino-2-methylpropoxy)-N-ethylacetamide
CID 64537603
2-[(4-aminophenyl)methoxy]-N-benzylacetamide
CID 28973831
2-(2-amino-2-methylpropoxy)-N-(2-bromophenyl)acetamide
CID 64537800
2-[3-(benzylamino)-2,2-dimethylpropoxy]-N-carbamoylacetamide
CID 106938877
2-[(1-aminocycloheptyl)methoxy]-N-benzylacetamide
CID 64549778
N-benzyl-2-(methoxyamino)acetamide
CID 60702706
N-benzyl-4,4-dimethylpentanamide
CID 59836653
[2-(benzylamino)-2-oxoethyl] 2,6-dimethylbenzoate
CID 171350713
N-[[4-(2-aminoethyl)phenyl]methyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103806176
2-amino-N-[2-(benzylamino)-2-oxoethyl]-3,3,3-trifluoro-2-methylpropanamide
CID 79792967
tert-butyl N-[2-(benzylamino)-2-oxoethyl]carbamate;methanamine
CID 145259972

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-methylpropoxy)-N-benzylacetamide?
The IUPAC name of 2-(2-amino-2-methylpropoxy)-N-benzylacetamide (CID 64537589) is 2-(2-amino-2-methylpropoxy)-N-benzylacetamide.
What is the SMILES notation for 2-(2-amino-2-methylpropoxy)-N-benzylacetamide?
The canonical SMILES for 2-(2-amino-2-methylpropoxy)-N-benzylacetamide is CC(C)(N)COCC(=O)NCc1ccccc1.
What is the InChIKey of 2-(2-amino-2-methylpropoxy)-N-benzylacetamide?
The InChIKey is VKYWKCZYUVAIJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-13(2,14)10-17-9-12(16)15-8-11-6-4-3-5-7-11/h3-7H,8-10,14H2,1-2H3,(H,15,16).
What are the key properties of 2-(2-amino-2-methylpropoxy)-N-benzylacetamide?
2-(2-amino-2-methylpropoxy)-N-benzylacetamide has a molecular weight of 236.31 g/mol, XLogP of 1.06, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-methylpropoxy)-N-benzylacetamide is sourced from PubChem (CID 64537589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).