N-(benzimidazol-2-ylideneamino)-N-methylmethanamine

C9H10N4 — CID 23063837

IUPACN-(benzimidazol-2-ylideneamino)-N-methylmethanamine
SMILESCN(C)N=C1N=c2ccccc2=N1
InChIInChI=1S/C9H10N4/c1-13(2)12-9-10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3
InChIKeyVJBKGUCHHQYZPC-UHFFFAOYSA-N
MW174.21 g/mol
LogP-0.23
Rot. Bonds1

About N-(benzimidazol-2-ylideneamino)-N-methylmethanamine

N-(benzimidazol-2-ylideneamino)-N-methylmethanamine (PubChem CID 23063837) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is N-(benzimidazol-2-ylideneamino)-N-methylmethanamine.

Molecular Properties

Compound NameN-(benzimidazol-2-ylideneamino)-N-methylmethanamine
PubChem CID23063837
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC NameN-(benzimidazol-2-ylideneamino)-N-methylmethanamine
SMILESCN(C)N=C1N=c2ccccc2=N1
InChIInChI=1S/C9H10N4/c1-13(2)12-9-10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3
InChIKeyVJBKGUCHHQYZPC-UHFFFAOYSA-N
XLogP-0.23
TPSA40.32 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(benzimidazol-2-ylideneamino)-N-methylmethanamine?
The IUPAC name of N-(benzimidazol-2-ylideneamino)-N-methylmethanamine (CID 23063837) is N-(benzimidazol-2-ylideneamino)-N-methylmethanamine.
What is the SMILES notation for N-(benzimidazol-2-ylideneamino)-N-methylmethanamine?
The canonical SMILES for N-(benzimidazol-2-ylideneamino)-N-methylmethanamine is CN(C)N=C1N=c2ccccc2=N1.
What is the InChIKey of N-(benzimidazol-2-ylideneamino)-N-methylmethanamine?
The InChIKey is VJBKGUCHHQYZPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c1-13(2)12-9-10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3.
What are the key properties of N-(benzimidazol-2-ylideneamino)-N-methylmethanamine?
N-(benzimidazol-2-ylideneamino)-N-methylmethanamine has a molecular weight of 174.21 g/mol, XLogP of -0.23, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzimidazol-2-ylideneamino)-N-methylmethanamine is sourced from PubChem (CID 23063837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).