2-(N-ethyl-3-methylanilino)ethanimidamide

C11H17N3 — CID 61075863

IUPAC2-(N-ethyl-3-methylanilino)ethanimidamide
SMILES[H]/N=C(\N)CN(CC)c1cccc(C)c1
InChIInChI=1S/C11H17N3/c1-3-14(8-11(12)13)10-6-4-5-9(2)7-10/h4-7H,3,8H2,1-2H3,(H3,12,13)
InChIKeyDOBFNWZOQSNNNV-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.76
Rot. Bonds4

About 2-(N-ethyl-3-methylanilino)ethanimidamide

2-(N-ethyl-3-methylanilino)ethanimidamide (PubChem CID 61075863) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-(N-ethyl-3-methylanilino)ethanimidamide.

Molecular Properties

Compound Name2-(N-ethyl-3-methylanilino)ethanimidamide
PubChem CID61075863
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-(N-ethyl-3-methylanilino)ethanimidamide
SMILES[H]/N=C(\N)CN(CC)c1cccc(C)c1
InChIInChI=1S/C11H17N3/c1-3-14(8-11(12)13)10-6-4-5-9(2)7-10/h4-7H,3,8H2,1-2H3,(H3,12,13)
InChIKeyDOBFNWZOQSNNNV-UHFFFAOYSA-N
XLogP1.76
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 ≤ 51.76
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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Related Compounds

3-(N-ethyl-3-methylanilino)propanimidamide;dihydrochloride
CID 42614728
4-[(N-ethyl-3-methylanilino)methyl]-3-fluorobenzenecarboximidamide
CID 61075864
3-(N-ethyl-3-methylanilino)propanethioamide
CID 39160770
1-(N-ethyl-3-methylanilino)pentan-2-one
CID 62044649
N,N'-diethyl-N,N'-bis(3-methylphenyl)propane-1,3-diamine
CID 57172568
potassium 3-(N-ethyl-3-methylanilino)prop-1-en-2-yl-trifluoroboranuide
CID 106745772
3-(diaminomethylidene)-1-ethyl-1-(3-methylphenyl)guanidine
CID 115563267
ethane;2-(N-ethyl-3-methylanilino)ethanol
CID 142945476
2-[[2-(N-ethyl-3-methylanilino)acetyl]amino]benzamide
CID 47078032
2-(N-ethyl-3-methylanilino)-N,N-dipropylacetamide
CID 109006691
1-(N-ethyl-3-methylanilino)-3-methoxypropan-2-one
CID 107507164
2-(N-ethyl-3-methylanilino)benzenecarboximidamide
CID 61075693

Frequently Asked Questions

What is the IUPAC name of 2-(N-ethyl-3-methylanilino)ethanimidamide?
The IUPAC name of 2-(N-ethyl-3-methylanilino)ethanimidamide (CID 61075863) is 2-(N-ethyl-3-methylanilino)ethanimidamide.
What is the SMILES notation for 2-(N-ethyl-3-methylanilino)ethanimidamide?
The canonical SMILES for 2-(N-ethyl-3-methylanilino)ethanimidamide is [H]/N=C(\N)CN(CC)c1cccc(C)c1.
What is the InChIKey of 2-(N-ethyl-3-methylanilino)ethanimidamide?
The InChIKey is DOBFNWZOQSNNNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-3-14(8-11(12)13)10-6-4-5-9(2)7-10/h4-7H,3,8H2,1-2H3,(H3,12,13).
What are the key properties of 2-(N-ethyl-3-methylanilino)ethanimidamide?
2-(N-ethyl-3-methylanilino)ethanimidamide has a molecular weight of 191.28 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-ethyl-3-methylanilino)ethanimidamide is sourced from PubChem (CID 61075863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).