N',2-diethyl-3-methylbenzenecarboximidamide

C12H18N2 — CID 129196541

IUPACN',2-diethyl-3-methylbenzenecarboximidamide
SMILESCC/N=C(\N)c1cccc(C)c1CC
InChIInChI=1S/C12H18N2/c1-4-10-9(3)7-6-8-11(10)12(13)14-5-2/h6-8H,4-5H2,1-3H3,(H2,13,14)
InChIKeyUVECZWCLJSCSFA-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.28
Rot. Bonds3

About N',2-diethyl-3-methylbenzenecarboximidamide

N',2-diethyl-3-methylbenzenecarboximidamide (PubChem CID 129196541) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N',2-diethyl-3-methylbenzenecarboximidamide.

Molecular Properties

Compound NameN',2-diethyl-3-methylbenzenecarboximidamide
PubChem CID129196541
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN',2-diethyl-3-methylbenzenecarboximidamide
SMILESCC/N=C(\N)c1cccc(C)c1CC
InChIInChI=1S/C12H18N2/c1-4-10-9(3)7-6-8-11(10)12(13)14-5-2/h6-8H,4-5H2,1-3H3,(H2,13,14)
InChIKeyUVECZWCLJSCSFA-UHFFFAOYSA-N
XLogP2.28
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.28
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-diethyl-3-methylbenzenecarboximidamide?
The IUPAC name of N',2-diethyl-3-methylbenzenecarboximidamide (CID 129196541) is N',2-diethyl-3-methylbenzenecarboximidamide.
What is the SMILES notation for N',2-diethyl-3-methylbenzenecarboximidamide?
The canonical SMILES for N',2-diethyl-3-methylbenzenecarboximidamide is CC/N=C(\N)c1cccc(C)c1CC.
What is the InChIKey of N',2-diethyl-3-methylbenzenecarboximidamide?
The InChIKey is UVECZWCLJSCSFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-4-10-9(3)7-6-8-11(10)12(13)14-5-2/h6-8H,4-5H2,1-3H3,(H2,13,14).
What are the key properties of N',2-diethyl-3-methylbenzenecarboximidamide?
N',2-diethyl-3-methylbenzenecarboximidamide has a molecular weight of 190.29 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N',2-diethyl-3-methylbenzenecarboximidamide is sourced from PubChem (CID 129196541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).