2-methyl-3-(N-methylanilino)propanimidamide

C11H17N3 — CID 43175003

IUPAC2-methyl-3-(N-methylanilino)propanimidamide
SMILES[H]/N=C(\N)C(C)CN(C)c1ccccc1
InChIInChI=1S/C11H17N3/c1-9(11(12)13)8-14(2)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H3,12,13)
InChIKeyLWJAPIXYGZJHOU-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.69
Rot. Bonds4

About 2-methyl-3-(N-methylanilino)propanimidamide

2-methyl-3-(N-methylanilino)propanimidamide (PubChem CID 43175003) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-methyl-3-(N-methylanilino)propanimidamide.

Molecular Properties

Compound Name2-methyl-3-(N-methylanilino)propanimidamide
PubChem CID43175003
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-methyl-3-(N-methylanilino)propanimidamide
SMILES[H]/N=C(\N)C(C)CN(C)c1ccccc1
InChIInChI=1S/C11H17N3/c1-9(11(12)13)8-14(2)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H3,12,13)
InChIKeyLWJAPIXYGZJHOU-UHFFFAOYSA-N
XLogP1.69
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 2-methyl-3-(N-methylanilino)propanimidamide?
The IUPAC name of 2-methyl-3-(N-methylanilino)propanimidamide (CID 43175003) is 2-methyl-3-(N-methylanilino)propanimidamide.
What is the SMILES notation for 2-methyl-3-(N-methylanilino)propanimidamide?
The canonical SMILES for 2-methyl-3-(N-methylanilino)propanimidamide is [H]/N=C(\N)C(C)CN(C)c1ccccc1.
What is the InChIKey of 2-methyl-3-(N-methylanilino)propanimidamide?
The InChIKey is LWJAPIXYGZJHOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-9(11(12)13)8-14(2)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H3,12,13).
What are the key properties of 2-methyl-3-(N-methylanilino)propanimidamide?
2-methyl-3-(N-methylanilino)propanimidamide has a molecular weight of 191.28 g/mol, XLogP of 1.69, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(N-methylanilino)propanimidamide is sourced from PubChem (CID 43175003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).