[3-(acetamidomethyl)phenyl]-methyltin

C10H13NOSn — CID 59658577

IUPAC[3-(acetamidomethyl)phenyl]-methyltin
SMILESC[Sn]c1cccc(CNC(C)=O)c1
InChIInChI=1S/C9H10NO.CH3.Sn/c1-8(11)10-7-9-5-3-2-4-6-9;;/h2-3,5-6H,7H2,1H3,(H,10,11);1H3;
InChIKeyJUMHANNKMDBZDG-UHFFFAOYSA-N
MW281.93 g/mol
LogP0.70
Rot. Bonds3

About [3-(acetamidomethyl)phenyl]-methyltin

[3-(acetamidomethyl)phenyl]-methyltin (PubChem CID 59658577) has the molecular formula C10H13NOSn and a molecular weight of 281.93 g/mol. Its IUPAC name is [3-(acetamidomethyl)phenyl]-methyltin.

Molecular Properties

Compound Name[3-(acetamidomethyl)phenyl]-methyltin
PubChem CID59658577
Molecular FormulaC10H13NOSn
Molecular Weight281.93 g/mol
Exact Mass283.00
IUPAC Name[3-(acetamidomethyl)phenyl]-methyltin
SMILESC[Sn]c1cccc(CNC(C)=O)c1
InChIInChI=1S/C9H10NO.CH3.Sn/c1-8(11)10-7-9-5-3-2-4-6-9;;/h2-3,5-6H,7H2,1H3,(H,10,11);1H3;
InChIKeyJUMHANNKMDBZDG-UHFFFAOYSA-N
XLogP0.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.93
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[3-[[3-(acetamidomethyl)phenyl]disulfanyl]phenyl]methyl]acetamide
CID 118256362
methyl 3-(acetamidomethyl)benzoate
CID 20717921
N-[[3,5-bis(acetamidomethyl)phenyl]methyl]acetamide
CID 70538979
N-[[3-(4-hydroxyphenyl)phenyl]methyl]acetamide
CID 56704021
N-[[3-(1-hydroxyethenylamino)phenyl]methyl]acetamide
CID 118883103
S-methyl N-[[3-[(methylsulfanylcarbonylamino)methyl]phenyl]methyl]carbamothioate
CID 58004919
N-benzylacetamide;toluene
CID 175498463
N-benzylacetamide;ethanamine
CID 22257034
N-[[3-[[ethyl(propyl)amino]methyl]phenyl]methyl]acetamide
CID 143915548
N-[[3-(2-amino-4-pyridinyl)phenyl]methyl]acetamide
CID 144513421
N-[4-[(3-methylphenyl)methylcarbamoylamino]phenyl]acetamide
CID 108898073
N-[[3-[(4-chloro-N-methylanilino)methyl]phenyl]methyl]acetamide
CID 143248637

Frequently Asked Questions

What is the IUPAC name of [3-(acetamidomethyl)phenyl]-methyltin?
The IUPAC name of [3-(acetamidomethyl)phenyl]-methyltin (CID 59658577) is [3-(acetamidomethyl)phenyl]-methyltin.
What is the SMILES notation for [3-(acetamidomethyl)phenyl]-methyltin?
The canonical SMILES for [3-(acetamidomethyl)phenyl]-methyltin is C[Sn]c1cccc(CNC(C)=O)c1.
What is the InChIKey of [3-(acetamidomethyl)phenyl]-methyltin?
The InChIKey is JUMHANNKMDBZDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10NO.CH3.Sn/c1-8(11)10-7-9-5-3-2-4-6-9;;/h2-3,5-6H,7H2,1H3,(H,10,11);1H3;.
What are the key properties of [3-(acetamidomethyl)phenyl]-methyltin?
[3-(acetamidomethyl)phenyl]-methyltin has a molecular weight of 281.93 g/mol, XLogP of 0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(acetamidomethyl)phenyl]-methyltin is sourced from PubChem (CID 59658577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).