carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)

C11H18N2W — CID 58578255

IUPACcarbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)
SMILESCC1=NCC(C2CC[N-]CC2)=C1.[CH3-].[W+2]
InChIInChI=1S/C10H15N2.CH3.W/c1-8-6-10(7-12-8)9-2-4-11-5-3-9;;/h6,9H,2-5,7H2,1H3;1H3;/q2*-1;+2
InChIKeyWQQPVJHTZNKSHB-UHFFFAOYSA-N
MW362.12 g/mol
LogP2.62
Rot. Bonds1

About carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)

carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+) (PubChem CID 58578255) has the molecular formula C11H18N2W and a molecular weight of 362.12 g/mol. Its IUPAC name is carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+).

Molecular Properties

Compound Namecarbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)
PubChem CID58578255
Molecular FormulaC11H18N2W
Molecular Weight362.12 g/mol
Exact Mass362.10
IUPAC Namecarbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)
SMILESCC1=NCC(C2CC[N-]CC2)=C1.[CH3-].[W+2]
InChIInChI=1S/C10H15N2.CH3.W/c1-8-6-10(7-12-8)9-2-4-11-5-3-9;;/h6,9H,2-5,7H2,1H3;1H3;/q2*-1;+2
InChIKeyWQQPVJHTZNKSHB-UHFFFAOYSA-N
XLogP2.62
TPSA26.46 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.12
LogP ≤ 52.62
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-(1-ethylpiperidin-4-yl)-2H-indole
CID 57002424
5-Propan-2-yl-2,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
CID 57530991
4-(5-methyl-2H-pyrrol-3-yl)piperidine
CID 58578256
5-Methyl-2,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
CID 90326755
1-prop-1-en-2-yl-4-(2H-pyrrol-3-yl)piperidine
CID 130217430
7-Methyl-2,3,4,6,8,9-hexahydropyrido[4,3-b]azepine
CID 141946412
5-ethyl-7-(1-methylpiperidin-4-yl)-2H-azepine
CID 142941032
(3Z)-N,1-dimethyl-3-propylidenepiperidin-4-imine
CID 143453287
4-(5-methyl-2H-pyrrol-3-yl)piperidine;hydrochloride
CID 160120254
(2Z)-N-methyl-1-(4-methylcyclohexa-2,4-dien-1-yl)-4-(piperidin-1-ylmethyl)penta-2,4-dien-1-imine
CID 166855694
ethane;(3Z)-N-ethyl-3-ethylidene-1-propan-2-ylpiperidin-4-imine
CID 170634196
(3Z)-3-ethylidene-N-methyl-1-(3-methylpent-1-en-2-yl)piperidin-4-imine
CID 172383541

Frequently Asked Questions

What is the IUPAC name of carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)?
The IUPAC name of carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+) (CID 58578255) is carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+).
What is the SMILES notation for carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)?
The canonical SMILES for carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+) is CC1=NCC(C2CC[N-]CC2)=C1.[CH3-].[W+2].
What is the InChIKey of carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)?
The InChIKey is WQQPVJHTZNKSHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N2.CH3.W/c1-8-6-10(7-12-8)9-2-4-11-5-3-9;;/h6,9H,2-5,7H2,1H3;1H3;/q2*-1;+2.
What are the key properties of carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+)?
carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+) has a molecular weight of 362.12 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;4-(5-methyl-2H-pyrrol-3-yl)piperidin-1-ide;tungsten(2+) is sourced from PubChem (CID 58578255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).