[4-(dimethylamino)phenyl]methyl-λ2-stannane

C9H13NSn — CID 174712145

IUPAC[4-(dimethylamino)phenyl]methyl-λ2-stannane
SMILESCN(C)c1ccc(C[SnH])cc1
InChIInChI=1S/C9H12N.Sn.H/c1-8-4-6-9(7-5-8)10(2)3;;/h4-7H,1H2,2-3H3;;
InChIKeyNOTQVBSISSIHHP-UHFFFAOYSA-N
MW253.92 g/mol
LogP1.15
Rot. Bonds2

About [4-(dimethylamino)phenyl]methyl-λ2-stannane

[4-(dimethylamino)phenyl]methyl-λ2-stannane (PubChem CID 174712145) has the molecular formula C9H13NSn and a molecular weight of 253.92 g/mol. Its IUPAC name is [4-(dimethylamino)phenyl]methyl-λ2-stannane.

Molecular Properties

Compound Name[4-(dimethylamino)phenyl]methyl-λ2-stannane
PubChem CID174712145
Molecular FormulaC9H13NSn
Molecular Weight253.92 g/mol
Exact Mass255.01
IUPAC Name[4-(dimethylamino)phenyl]methyl-λ2-stannane
SMILESCN(C)c1ccc(C[SnH])cc1
InChIInChI=1S/C9H12N.Sn.H/c1-8-4-6-9(7-5-8)10(2)3;;/h4-7H,1H2,2-3H3;;
InChIKeyNOTQVBSISSIHHP-UHFFFAOYSA-N
XLogP1.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.92
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)phenyl]methyl-λ2-stannane?
The IUPAC name of [4-(dimethylamino)phenyl]methyl-λ2-stannane (CID 174712145) is [4-(dimethylamino)phenyl]methyl-λ2-stannane.
What is the SMILES notation for [4-(dimethylamino)phenyl]methyl-λ2-stannane?
The canonical SMILES for [4-(dimethylamino)phenyl]methyl-λ2-stannane is CN(C)c1ccc(C[SnH])cc1.
What is the InChIKey of [4-(dimethylamino)phenyl]methyl-λ2-stannane?
The InChIKey is NOTQVBSISSIHHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N.Sn.H/c1-8-4-6-9(7-5-8)10(2)3;;/h4-7H,1H2,2-3H3;;.
What are the key properties of [4-(dimethylamino)phenyl]methyl-λ2-stannane?
[4-(dimethylamino)phenyl]methyl-λ2-stannane has a molecular weight of 253.92 g/mol, XLogP of 1.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)phenyl]methyl-λ2-stannane is sourced from PubChem (CID 174712145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).