N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide

C32H32N2O3 — CID 169449646

IUPACN,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide
SMILESO=C(COCC(=O)N(Cc1ccccc1)Cc1ccccc1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C32H32N2O3/c35-31(33(21-27-13-5-1-6-14-27)22-28-15-7-2-8-16-28)25-37-26-32(36)34(23-29-17-9-3-10-18-29)24-30-19-11-4-12-20-30/h1-20H,21-26H2
InChIKeyVZSLDEPHWUKRRW-UHFFFAOYSA-N
MW492.62 g/mol
LogP5.46
Rot. Bonds12

About N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide

N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide (PubChem CID 169449646) has the molecular formula C32H32N2O3 and a molecular weight of 492.62 g/mol. Its IUPAC name is N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide.

Molecular Properties

Compound NameN,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide
PubChem CID169449646
Molecular FormulaC32H32N2O3
Molecular Weight492.62 g/mol
Exact Mass492.24
IUPAC NameN,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide
SMILESO=C(COCC(=O)N(Cc1ccccc1)Cc1ccccc1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C32H32N2O3/c35-31(33(21-27-13-5-1-6-14-27)22-28-15-7-2-8-16-28)25-37-26-32(36)34(23-29-17-9-3-10-18-29)24-30-19-11-4-12-20-30/h1-20H,21-26H2
InChIKeyVZSLDEPHWUKRRW-UHFFFAOYSA-N
XLogP5.46
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.62
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-Benzyl-2-methyl-9-(2-phenylethyl)-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 118562403
2,2'-oxybis(N-benzylacetamide)
CID 2322352
1-(9-Benzhydryl-3,9-diazaspiro[5.5]undecan-3-yl)-2-methoxyethanone
CID 3234683
1-(2-Benzhydryl-2,9-diazaspiro[5.5]undecan-9-yl)-2-methoxyethanone
CID 3234777
N-benzyl-2-ethoxy-N-ethylacetamide
CID 2162886
N,N,N',N'-tetrabenzylpropanediamide
CID 2384529
4-(1-Benzyl-piperidin-4-yl)-morpholin-3-one
CID 69145540
N-benzyl-N-ethyl-2-methoxyacetamide
CID 807800
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]ethanone
CID 3621648
2-methoxy-N-methyl-N-[(4-phenylphenyl)methyl]acetamide
CID 134054110
Ethyl (dibenzylamino)(oxo)acetate
CID 4419728
1,4-Dibenzyl-3,6-dimethoxypiperazine-2,5-dione
CID 14762483

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide?
The IUPAC name of N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide (CID 169449646) is N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide.
What is the SMILES notation for N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide?
The canonical SMILES for N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide is O=C(COCC(=O)N(Cc1ccccc1)Cc1ccccc1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide?
The InChIKey is VZSLDEPHWUKRRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H32N2O3/c35-31(33(21-27-13-5-1-6-14-27)22-28-15-7-2-8-16-28)25-37-26-32(36)34(23-29-17-9-3-10-18-29)24-30-19-11-4-12-20-30/h1-20H,21-26H2.
What are the key properties of N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide?
N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide has a molecular weight of 492.62 g/mol, XLogP of 5.46, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-2-[2-(dibenzylamino)-2-oxoethoxy]acetamide is sourced from PubChem (CID 169449646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).