ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum

C19H25N5OPt — CID 142609872

IUPACethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum
SMILESNCCN.O=C(Cc1ccncc1)NCCc1c[nH]c2ccccc12.[Pt]
InChIInChI=1S/C17H17N3O.C2H8N2.Pt/c21-17(11-13-5-8-18-9-6-13)19-10-7-14-12-20-16-4-2-1-3-15(14)16;3-1-2-4;/h1-6,8-9,12,20H,7,10-11H2,(H,19,21);1-4H2;
InChIKeyVELQFEOMPICOHQ-UHFFFAOYSA-N
MW534.52 g/mol
LogP1.37
Rot. Bonds6

About ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum

ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum (PubChem CID 142609872) has the molecular formula C19H25N5OPt and a molecular weight of 534.52 g/mol. Its IUPAC name is ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum.

Molecular Properties

Compound Nameethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum
PubChem CID142609872
Molecular FormulaC19H25N5OPt
Molecular Weight534.52 g/mol
Exact Mass534.17
IUPAC Nameethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum
SMILESNCCN.O=C(Cc1ccncc1)NCCc1c[nH]c2ccccc12.[Pt]
InChIInChI=1S/C17H17N3O.C2H8N2.Pt/c21-17(11-13-5-8-18-9-6-13)19-10-7-14-12-20-16-4-2-1-3-15(14)16;3-1-2-4;/h1-6,8-9,12,20H,7,10-11H2,(H,19,21);1-4H2;
InChIKeyVELQFEOMPICOHQ-UHFFFAOYSA-N
XLogP1.37
TPSA109.82 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500534.52
LogP ≤ 51.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum?
The IUPAC name of ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum (CID 142609872) is ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum.
What is the SMILES notation for ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum?
The canonical SMILES for ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum is NCCN.O=C(Cc1ccncc1)NCCc1c[nH]c2ccccc12.[Pt].
What is the InChIKey of ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum?
The InChIKey is VELQFEOMPICOHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O.C2H8N2.Pt/c21-17(11-13-5-8-18-9-6-13)19-10-7-14-12-20-16-4-2-1-3-15(14)16;3-1-2-4;/h1-6,8-9,12,20H,7,10-11H2,(H,19,21);1-4H2;.
What are the key properties of ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum?
ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum has a molecular weight of 534.52 g/mol, XLogP of 1.37, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane-1,2-diamine;N-[2-(1H-indol-3-yl)ethyl]-2-pyridin-4-ylacetamide;platinum is sourced from PubChem (CID 142609872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).