N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)

C9H10N2W — CID 59567148

IUPACN-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)
SMILESCC/[C-]=N/c1[c-]ccnc1C.[W+2]
InChIInChI=1S/C9H10N2.W/c1-3-6-11-9-5-4-7-10-8(9)2;/h4,7H,3H2,1-2H3;/q-2;+2
InChIKeyYYBVSZRDOYDOTQ-UHFFFAOYSA-N
MW330.03 g/mol
LogP2.18
Rot. Bonds2

About N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)

N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+) (PubChem CID 59567148) has the molecular formula C9H10N2W and a molecular weight of 330.03 g/mol. Its IUPAC name is N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+).

Molecular Properties

Compound NameN-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)
PubChem CID59567148
Molecular FormulaC9H10N2W
Molecular Weight330.03 g/mol
Exact Mass330.04
IUPAC NameN-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)
SMILESCC/[C-]=N/c1[c-]ccnc1C.[W+2]
InChIInChI=1S/C9H10N2.W/c1-3-6-11-9-5-4-7-10-8(9)2;/h4,7H,3H2,1-2H3;/q-2;+2
InChIKeyYYBVSZRDOYDOTQ-UHFFFAOYSA-N
XLogP2.18
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.03
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)
CID 59567153
N-(2-methyl-3H-pyridin-3-id-4-yl)propan-1-imine;tungsten(2+)
CID 59659048
2-N-prop-1-en-2-yl-1-N-propylcyclohexa-3,5-diene-1,2-diimine
CID 68004177
N-methyl-3-prop-2-enylidenepyridazin-4-imine
CID 123739571
1-N,2-N-bis(ethenyl)cyclohexa-3,5-diene-1,2-diimine
CID 130311120
1-Methyl-5,6-dihydropyrrolo[3,2-b]pyridine
CID 139471457
2-N-ethenyl-1-N-methylcyclohexa-3,5-diene-1,2-diimine
CID 142238523
ethane;2-N-ethenyl-1-N-methylcyclohexa-3,5-diene-1,2-diimine
CID 142933098
N-[(Z)-2-(methylideneamino)prop-1-enyl]cyclohexa-2,4-dien-1-imine
CID 143168265
1-N,2-N-bis(ethenyl)cyclohexa-3,5-diene-1,2-diimine;ethane
CID 144460563
carbanide;2-ethenyl-4-methyl-3H-pyridin-3-ide;yttrium(3+)
CID 145773128
carbanide;4-ethenyl-2-methyl-3H-pyridin-3-ide;yttrium(3+)
CID 145773189

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)?
The IUPAC name of N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+) (CID 59567148) is N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+).
What is the SMILES notation for N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)?
The canonical SMILES for N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+) is CC/[C-]=N/c1[c-]ccnc1C.[W+2].
What is the InChIKey of N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)?
The InChIKey is YYBVSZRDOYDOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2.W/c1-3-6-11-9-5-4-7-10-8(9)2;/h4,7H,3H2,1-2H3;/q-2;+2.
What are the key properties of N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)?
N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+) has a molecular weight of 330.03 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+) is sourced from PubChem (CID 59567148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).