carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)

C13H27NOW — CID 23395973

IUPACcarbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)
SMILESCCCOC1CCC(CC[N-]C)CC1.[CH3-].[W+2]
InChIInChI=1S/C12H24NO.CH3.W/c1-3-10-14-12-6-4-11(5-7-12)8-9-13-2;;/h11-12H,3-10H2,1-2H3;1H3;/q2*-1;+2
InChIKeyCCRDYWDKRLWWKK-UHFFFAOYSA-N
MW397.21 g/mol
LogP3.81
Rot. Bonds6

About carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)

carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+) (PubChem CID 23395973) has the molecular formula C13H27NOW and a molecular weight of 397.21 g/mol. Its IUPAC name is carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+).

Molecular Properties

Compound Namecarbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)
PubChem CID23395973
Molecular FormulaC13H27NOW
Molecular Weight397.21 g/mol
Exact Mass397.16
IUPAC Namecarbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)
SMILESCCCOC1CCC(CC[N-]C)CC1.[CH3-].[W+2]
InChIInChI=1S/C12H24NO.CH3.W/c1-3-10-14-12-6-4-11(5-7-12)8-9-13-2;;/h11-12H,3-10H2,1-2H3;1H3;/q2*-1;+2
InChIKeyCCRDYWDKRLWWKK-UHFFFAOYSA-N
XLogP3.81
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.21
LogP ≤ 53.81
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

2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine
CID 176558045
Carbanide;2-[4-[2-(dimethylamino)ethoxy]cyclohexyl]ethyl-methylazanide;tungsten(2+)
CID 23395946
Carbanide;2-[4-(2-hydroxyethoxy)cyclohexyl]ethyl-methylazanide;tungsten(2+)
CID 23395948
N,N-dimethyl-1-[3-(2-methylpropoxy)cyclohexyl]methanamine
CID 139741207
N-ethyl-N-methyl-3-(4-propan-2-yloxycyclohexyl)propan-1-amine
CID 145816095
N-ethyl-N-methyl-3-[4-(2-methylpropoxy)cyclohexyl]propan-1-amine
CID 145816098
N-methyl-N-[(4-propan-2-yloxycyclohexyl)methyl]propan-1-amine
CID 163967088
Trimethyl-[[4-(2-propan-2-yloxyethyl)cyclohexyl]methyl]azanium
CID 172116706
1-[2-(4-Methoxycyclohexyl)ethyl]-3-methylpyrrolidine
CID 172563902
N-methyl-4-(4-methylcyclohexyl)oxy-N-propylbutan-1-amine
CID 174464248
N,N-dimethyl-2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine
CID 176728249
1-Ethyl-4-(4-ethylcyclohexyl)oxypiperidine
CID 176985843

Frequently Asked Questions

What is the IUPAC name of carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)?
The IUPAC name of carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+) (CID 23395973) is carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+).
What is the SMILES notation for carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)?
The canonical SMILES for carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+) is CCCOC1CCC(CC[N-]C)CC1.[CH3-].[W+2].
What is the InChIKey of carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)?
The InChIKey is CCRDYWDKRLWWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24NO.CH3.W/c1-3-10-14-12-6-4-11(5-7-12)8-9-13-2;;/h11-12H,3-10H2,1-2H3;1H3;/q2*-1;+2.
What are the key properties of carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+)?
carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+) has a molecular weight of 397.21 g/mol, XLogP of 3.81, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;methyl-[2-(4-propoxycyclohexyl)ethyl]azanide;tungsten(2+) is sourced from PubChem (CID 23395973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).