3-chloro-2-tributylgermylaniline

C18H32ClGeN — CID 11537975

IUPAC3-chloro-2-tributylgermylaniline
SMILESCCCC[Ge](CCCC)(CCCC)c1c(N)cccc1Cl
InChIInChI=1S/C18H32ClGeN/c1-4-7-13-20(14-8-5-2,15-9-6-3)18-16(19)11-10-12-17(18)21/h10-12H,4-9,13-15,21H2,1-3H3
InChIKeyVBRFLHZXSAXAIU-UHFFFAOYSA-N
MW370.52 g/mol
LogP5.98
Rot. Bonds10

About 3-chloro-2-tributylgermylaniline

3-chloro-2-tributylgermylaniline (PubChem CID 11537975) has the molecular formula C18H32ClGeN and a molecular weight of 370.52 g/mol. Its IUPAC name is 3-chloro-2-tributylgermylaniline.

Molecular Properties

Compound Name3-chloro-2-tributylgermylaniline
PubChem CID11537975
Molecular FormulaC18H32ClGeN
Molecular Weight370.52 g/mol
Exact Mass371.14
IUPAC Name3-chloro-2-tributylgermylaniline
SMILESCCCC[Ge](CCCC)(CCCC)c1c(N)cccc1Cl
InChIInChI=1S/C18H32ClGeN/c1-4-7-13-20(14-8-5-2,15-9-6-3)18-16(19)11-10-12-17(18)21/h10-12H,4-9,13-15,21H2,1-3H3
InChIKeyVBRFLHZXSAXAIU-UHFFFAOYSA-N
XLogP5.98
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.52
LogP ≤ 55.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

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2-(4-butylphenoxy)-3-chloroaniline
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2-N-butyl-3-chloro-2-N-cyclopropylbenzene-1,2-diamine
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3-chloro-2-propylsulfinylaniline
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2-(2-butoxyethoxy)-6-chloroaniline
CID 104834987
1-chloronaphthalene;pentane
CID 19360859
2-decylbenzene-1,3-diamine
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2-amino-6-chloro-N-hexan-2-ylbenzamide
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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-tributylgermylaniline?
The IUPAC name of 3-chloro-2-tributylgermylaniline (CID 11537975) is 3-chloro-2-tributylgermylaniline.
What is the SMILES notation for 3-chloro-2-tributylgermylaniline?
The canonical SMILES for 3-chloro-2-tributylgermylaniline is CCCC[Ge](CCCC)(CCCC)c1c(N)cccc1Cl.
What is the InChIKey of 3-chloro-2-tributylgermylaniline?
The InChIKey is VBRFLHZXSAXAIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32ClGeN/c1-4-7-13-20(14-8-5-2,15-9-6-3)18-16(19)11-10-12-17(18)21/h10-12H,4-9,13-15,21H2,1-3H3.
What are the key properties of 3-chloro-2-tributylgermylaniline?
3-chloro-2-tributylgermylaniline has a molecular weight of 370.52 g/mol, XLogP of 5.98, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-tributylgermylaniline is sourced from PubChem (CID 11537975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).