CID 171589260

C17H38N3Sn — CID 171589260

IUPAC—
SMILESCCC(C)N(C(C)CC)[Sn]1N(C(C)(C)C)CN1C(C)(C)C
InChIInChI=1S/C9H20N2.C8H18N.Sn/c1-8(2,3)10-7-11-9(4,5)6;1-5-7(3)9-8(4)6-2;/h7H2,1-6H3;7-8H,5-6H2,1-4H3;/q-2;-1;+3
InChIKeyDDTOGOGDVYEDLF-UHFFFAOYSA-N
MW403.22 g/mol
LogP4.04
Rot. Bonds5

About CID 171589260

CID 171589260 (PubChem CID 171589260) has the molecular formula C17H38N3Sn and a molecular weight of 403.22 g/mol.

Molecular Properties

Compound NameCID 171589260
PubChem CID171589260
Molecular FormulaC17H38N3Sn
Molecular Weight403.22 g/mol
Exact Mass404.21
IUPAC Name—
SMILESCCC(C)N(C(C)CC)[Sn]1N(C(C)(C)C)CN1C(C)(C)C
InChIInChI=1S/C9H20N2.C8H18N.Sn/c1-8(2,3)10-7-11-9(4,5)6;1-5-7(3)9-8(4)6-2;/h7H2,1-6H3;7-8H,5-6H2,1-4H3;/q-2;-1;+3
InChIKeyDDTOGOGDVYEDLF-UHFFFAOYSA-N
XLogP4.04
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.22
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 171589226
CID 171589236
CID 171589236
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3,6-difluoro-2,3,6-trimethyloctane
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CID 171589189
CID 171589189
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Frequently Asked Questions

What is the IUPAC name of CID 171589260?
The IUPAC name of CID 171589260 (CID 171589260) is not available.
What is the SMILES notation for CID 171589260?
The canonical SMILES for CID 171589260 is CCC(C)N(C(C)CC)[Sn]1N(C(C)(C)C)CN1C(C)(C)C.
What is the InChIKey of CID 171589260?
The InChIKey is DDTOGOGDVYEDLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2.C8H18N.Sn/c1-8(2,3)10-7-11-9(4,5)6;1-5-7(3)9-8(4)6-2;/h7H2,1-6H3;7-8H,5-6H2,1-4H3;/q-2;-1;+3.
What are the key properties of CID 171589260?
CID 171589260 has a molecular weight of 403.22 g/mol, XLogP of 4.04, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 171589260 is sourced from PubChem (CID 171589260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).