carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)

C19H27MnN2 — CID 10893114

IUPACcarbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)
SMILESCN(C)Cc1[c-]cccc1.CN(C)Cc1[c-]cccc1.[CH3-].[Mn+3]
InChIInChI=1S/2C9H12N.CH3.Mn/c2*1-10(2)8-9-6-4-3-5-7-9;;/h2*3-6H,8H2,1-2H3;1H3;/q3*-1;+3
InChIKeyNNCZBAMCCHQCCI-UHFFFAOYSA-N
MW338.38 g/mol
LogP3.54
Rot. Bonds4

About carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)

carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+) (PubChem CID 10893114) has the molecular formula C19H27MnN2 and a molecular weight of 338.38 g/mol. Its IUPAC name is carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+).

Molecular Properties

Compound Namecarbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)
PubChem CID10893114
Molecular FormulaC19H27MnN2
Molecular Weight338.38 g/mol
Exact Mass338.16
IUPAC Namecarbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)
SMILESCN(C)Cc1[c-]cccc1.CN(C)Cc1[c-]cccc1.[CH3-].[Mn+3]
InChIInChI=1S/2C9H12N.CH3.Mn/c2*1-10(2)8-9-6-4-3-5-7-9;;/h2*3-6H,8H2,1-2H3;1H3;/q3*-1;+3
InChIKeyNNCZBAMCCHQCCI-UHFFFAOYSA-N
XLogP3.54
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.38
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)?
The IUPAC name of carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+) (CID 10893114) is carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+).
What is the SMILES notation for carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)?
The canonical SMILES for carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+) is CN(C)Cc1[c-]cccc1.CN(C)Cc1[c-]cccc1.[CH3-].[Mn+3].
What is the InChIKey of carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)?
The InChIKey is NNCZBAMCCHQCCI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H12N.CH3.Mn/c2*1-10(2)8-9-6-4-3-5-7-9;;/h2*3-6H,8H2,1-2H3;1H3;/q3*-1;+3.
What are the key properties of carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+)?
carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+) has a molecular weight of 338.38 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;bis(N,N-dimethyl-1-phenylmethanamine);manganese(3+) is sourced from PubChem (CID 10893114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).