N'-(2-methylphenyl)cyclopropanecarboximidamide

C11H14N2 — CID 63178826

IUPACN'-(2-methylphenyl)cyclopropanecarboximidamide
SMILESCc1ccccc1/N=C(\N)C1CC1
InChIInChI=1S/C11H14N2/c1-8-4-2-3-5-10(8)13-11(12)9-6-7-9/h2-5,9H,6-7H2,1H3,(H2,12,13)
InChIKeyVNLVAFMKYKCMTO-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.39
Rot. Bonds2

About N'-(2-methylphenyl)cyclopropanecarboximidamide

N'-(2-methylphenyl)cyclopropanecarboximidamide (PubChem CID 63178826) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is N'-(2-methylphenyl)cyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-(2-methylphenyl)cyclopropanecarboximidamide
PubChem CID63178826
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC NameN'-(2-methylphenyl)cyclopropanecarboximidamide
SMILESCc1ccccc1/N=C(\N)C1CC1
InChIInChI=1S/C11H14N2/c1-8-4-2-3-5-10(8)13-11(12)9-6-7-9/h2-5,9H,6-7H2,1H3,(H2,12,13)
InChIKeyVNLVAFMKYKCMTO-UHFFFAOYSA-N
XLogP2.39
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(2-methylphenyl)cyclopropanecarboximidamide?
The IUPAC name of N'-(2-methylphenyl)cyclopropanecarboximidamide (CID 63178826) is N'-(2-methylphenyl)cyclopropanecarboximidamide.
What is the SMILES notation for N'-(2-methylphenyl)cyclopropanecarboximidamide?
The canonical SMILES for N'-(2-methylphenyl)cyclopropanecarboximidamide is Cc1ccccc1/N=C(\N)C1CC1.
What is the InChIKey of N'-(2-methylphenyl)cyclopropanecarboximidamide?
The InChIKey is VNLVAFMKYKCMTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-8-4-2-3-5-10(8)13-11(12)9-6-7-9/h2-5,9H,6-7H2,1H3,(H2,12,13).
What are the key properties of N'-(2-methylphenyl)cyclopropanecarboximidamide?
N'-(2-methylphenyl)cyclopropanecarboximidamide has a molecular weight of 174.25 g/mol, XLogP of 2.39, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methylphenyl)cyclopropanecarboximidamide is sourced from PubChem (CID 63178826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).