carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium

C15H35IrN3-4 — CID 135011154

IUPACcarbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium
SMILESCC(C)[N-]C([N-]C(C)C)N(C(C)C)C(C)C.[CH3-].[CH3-].[Ir]
InChIInChI=1S/C13H29N3.2CH3.Ir/c1-9(2)14-13(15-10(3)4)16(11(5)6)12(7)8;;;/h9-13H,1-8H3;2*1H3;/q-2;2*-1;
InChIKeyXKTHLJDNVPIMQB-UHFFFAOYSA-N
MW449.68 g/mol
LogP4.85
Rot. Bonds7

About carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium

carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium (PubChem CID 135011154) has the molecular formula C15H35IrN3-4 and a molecular weight of 449.68 g/mol. Its IUPAC name is carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium.

Molecular Properties

Compound Namecarbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium
PubChem CID135011154
Molecular FormulaC15H35IrN3-4
Molecular Weight449.68 g/mol
Exact Mass450.25
IUPAC Namecarbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium
SMILESCC(C)[N-]C([N-]C(C)C)N(C(C)C)C(C)C.[CH3-].[CH3-].[Ir]
InChIInChI=1S/C13H29N3.2CH3.Ir/c1-9(2)14-13(15-10(3)4)16(11(5)6)12(7)8;;;/h9-13H,1-8H3;2*1H3;/q-2;2*-1;
InChIKeyXKTHLJDNVPIMQB-UHFFFAOYSA-N
XLogP4.85
TPSA31.44 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.68
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 141200548
bis(di(propan-2-yl)azanide);neodymium;hydrochloride
CID 87163735
di(propan-2-yl)azanide;titanium(3+);dichloride
CID 160772025
N,N-di(propan-2-yl)propan-2-amine;hydrate
CID 173081552
carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium
CID 58635676
sodium [(dicyanoamino)-propan-2-ylazanidylmethyl]-propan-2-ylazanide
CID 153420852
tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)
CID 87312528
trilithium;bis(trimethylsilyl)azanide;di(propan-2-yl)azanide;hydride
CID 173345693
lithium;di(propan-2-yl)azanide;bis(trimethyl borate)
CID 23709742
1-fluoro-N,N,N',N'-tetra(propan-2-yl)methanediamine
CID 139882033
1-[1-hydroxyethyl(propan-2-yl)amino]ethanol
CID 57090083
N-[1-[1-[di(propan-2-yl)amino]ethoxy]ethyl]-N-propan-2-ylpropan-2-amine
CID 19822699

Frequently Asked Questions

What is the IUPAC name of carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium?
The IUPAC name of carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium (CID 135011154) is carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium.
What is the SMILES notation for carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium?
The canonical SMILES for carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium is CC(C)[N-]C([N-]C(C)C)N(C(C)C)C(C)C.[CH3-].[CH3-].[Ir].
What is the InChIKey of carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium?
The InChIKey is XKTHLJDNVPIMQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3.2CH3.Ir/c1-9(2)14-13(15-10(3)4)16(11(5)6)12(7)8;;;/h9-13H,1-8H3;2*1H3;/q-2;2*-1;.
What are the key properties of carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium?
carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium has a molecular weight of 449.68 g/mol, XLogP of 4.85, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium is sourced from PubChem (CID 135011154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).