N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)

C15H32NO2Ru+ — CID 169317196

IUPACN,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)
SMILESCCCN(CCC)CCC.C[C-](C)C.[CH-]=O.[CH-]=O.[Ru+4]
InChIInChI=1S/C9H21N.C4H9.2CHO.Ru/c1-4-7-10(8-5-2)9-6-3;1-4(2)3;2*1-2;/h4-9H2,1-3H3;1-3H3;2*1H;/q;3*-1;+4
InChIKeyKVILZBMVMXWBIJ-UHFFFAOYSA-N
MW359.50 g/mol
LogP3.59
Rot. Bonds6

About N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)

N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+) (PubChem CID 169317196) has the molecular formula C15H32NO2Ru+ and a molecular weight of 359.50 g/mol. Its IUPAC name is N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+).

Molecular Properties

Compound NameN,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)
PubChem CID169317196
Molecular FormulaC15H32NO2Ru+
Molecular Weight359.50 g/mol
Exact Mass360.15
IUPAC NameN,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)
SMILESCCCN(CCC)CCC.C[C-](C)C.[CH-]=O.[CH-]=O.[Ru+4]
InChIInChI=1S/C9H21N.C4H9.2CHO.Ru/c1-4-7-10(8-5-2)9-6-3;1-4(2)3;2*1-2;/h4-9H2,1-3H3;1-3H3;2*1H;/q;3*-1;+4
InChIKeyKVILZBMVMXWBIJ-UHFFFAOYSA-N
XLogP3.59
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.50
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 21315686
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N,N-dipropylpropan-1-amine;propane
CID 174574210
sodium;N,N-dipropylpropan-1-amine;chloride
CID 175189857
copper;N,N,N',N'-tetrapropylethane-1,2-diamine;dibromide
CID 173220545
N,N-diethylethanamine;N,N-dipropylpropan-1-amine
CID 22257187
copper;N,N,N',N'-tetrapropylethane-1,2-diamine;dichloride
CID 173220390
N-ethyl-N,N',N'-tripropylethane-1,2-diamine
CID 88655813
3-chloro-N,N-dipropylpropan-1-amine;hydrochloride
CID 19031570
N,N-dipropylpropan-1-amine;propan-1-ol;hydrochloride
CID 173448711
N,N-dipropylbutan-1-amine;hydrofluoride
CID 19783533
N-(2-iodoethyl)-N-propylpropan-1-amine
CID 88928815

Frequently Asked Questions

What is the IUPAC name of N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)?
The IUPAC name of N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+) (CID 169317196) is N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+).
What is the SMILES notation for N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)?
The canonical SMILES for N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+) is CCCN(CCC)CCC.C[C-](C)C.[CH-]=O.[CH-]=O.[Ru+4].
What is the InChIKey of N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)?
The InChIKey is KVILZBMVMXWBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N.C4H9.2CHO.Ru/c1-4-7-10(8-5-2)9-6-3;1-4(2)3;2*1-2;/h4-9H2,1-3H3;1-3H3;2*1H;/q;3*-1;+4.
What are the key properties of N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)?
N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+) has a molecular weight of 359.50 g/mol, XLogP of 3.59, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+) is sourced from PubChem (CID 169317196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).