N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide

C23H41NO2Sn — CID 10528779

IUPACN-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide
SMILESCCCC[Sn](CCCC)(CCCC)CN(Cc1ccc(OC)cc1)C(C)=O
InChIInChI=1S/C11H14NO2.3C4H9.Sn/c1-9(13)12(2)8-10-4-6-11(14-3)7-5-10;3*1-3-4-2;/h4-7H,2,8H2,1,3H3;3*1,3-4H2,2H3;
InChIKeyZNUZRIHPIZEDRK-UHFFFAOYSA-N
MW482.30 g/mol
LogP6.43
Rot. Bonds14

About N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide

N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide (PubChem CID 10528779) has the molecular formula C23H41NO2Sn and a molecular weight of 482.30 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide
PubChem CID10528779
Molecular FormulaC23H41NO2Sn
Molecular Weight482.30 g/mol
Exact Mass483.22
IUPAC NameN-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide
SMILESCCCC[Sn](CCCC)(CCCC)CN(Cc1ccc(OC)cc1)C(C)=O
InChIInChI=1S/C11H14NO2.3C4H9.Sn/c1-9(13)12(2)8-10-4-6-11(14-3)7-5-10;3*1-3-4-2;/h4-7H,2,8H2,1,3H3;3*1,3-4H2,2H3;
InChIKeyZNUZRIHPIZEDRK-UHFFFAOYSA-N
XLogP6.43
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.30
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-butyl-N-methylpropanamide
CID 113119927
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N,N-dipropylacetamide
CID 113163098
3-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-butylpropanamide
CID 113119864
3-[acetyl-[(4-methoxyphenyl)methyl]amino]-2-aminopropanoic acid
CID 163638856
N-[2-[acetyl-[(4-methoxyphenyl)methyl]amino]ethyl]butanamide
CID 113054996
N-butyl-N-[(4-methoxyphenyl)methyl]butan-1-amine
CID 6422491
2-bromo-N,N-bis[(4-methoxyphenyl)methyl]acetamide
CID 10904936
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-(4-ethylphenyl)acetamide
CID 113163115
2-[(4-methoxyphenyl)methyl-propylamino]acetic acid
CID 55026148
N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide
CID 113163156
N,N-dibutyl-4-methoxybenzamide
CID 2163395
3-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-(4-ethylphenyl)propanamide
CID 113119947

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide (CID 10528779) is N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide is CCCC[Sn](CCCC)(CCCC)CN(Cc1ccc(OC)cc1)C(C)=O.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide?
The InChIKey is ZNUZRIHPIZEDRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14NO2.3C4H9.Sn/c1-9(13)12(2)8-10-4-6-11(14-3)7-5-10;3*1-3-4-2;/h4-7H,2,8H2,1,3H3;3*1,3-4H2,2H3;.
What are the key properties of N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide?
N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide has a molecular weight of 482.30 g/mol, XLogP of 6.43, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide is sourced from PubChem (CID 10528779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).