2-(2-hydroxy-5-methylphenyl)ethanimidamide

C9H12N2O — CID 83676586

IUPAC2-(2-hydroxy-5-methylphenyl)ethanimidamide
SMILES[H]/N=C(\N)Cc1cc(C)ccc1O
InChIInChI=1S/C9H12N2O/c1-6-2-3-8(12)7(4-6)5-9(10)11/h2-4,12H,5H2,1H3,(H3,10,11)
InChIKeyYGANGVGOCFSZML-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.18
Rot. Bonds2

About 2-(2-hydroxy-5-methylphenyl)ethanimidamide

2-(2-hydroxy-5-methylphenyl)ethanimidamide (PubChem CID 83676586) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-(2-hydroxy-5-methylphenyl)ethanimidamide.

Molecular Properties

Compound Name2-(2-hydroxy-5-methylphenyl)ethanimidamide
PubChem CID83676586
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name2-(2-hydroxy-5-methylphenyl)ethanimidamide
SMILES[H]/N=C(\N)Cc1cc(C)ccc1O
InChIInChI=1S/C9H12N2O/c1-6-2-3-8(12)7(4-6)5-9(10)11/h2-4,12H,5H2,1H3,(H3,10,11)
InChIKeyYGANGVGOCFSZML-UHFFFAOYSA-N
XLogP1.18
TPSA70.10 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.18
H-Bond Donors ≤ 53
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

2-(diazenylmethyl)-4-methylphenol
CID 123647682
2-(2,3,4,5-tetrahydroxyphenyl)ethanimidamide
CID 18955472
2-(2-hydroxy-5-methylphenyl)acetic acid
CID 13360645
2-(2-hydroxy-5-methylphenyl)acetaldehyde
CID 23471205
2-(2,4,6-trimethylphenyl)ethanimidamide
CID 3660165
1-(2-hydroxy-5-methylphenyl)-N,N-dimethylmethanamine oxide
CID 11344368
2-(2-aminoethanimidoyl)-4-methylphenol
CID 142030299
2-(3-ethoxy-4-hydroxyphenyl)ethanimidamide
CID 91756255
2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide
CID 62160967
2-[2-(2-hydroxyphenyl)ethyl]-4-methylphenol
CID 154267038
2-[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenol;tetrachlorotungsten
CID 153466850
(E)-5-(2-hydroxy-5-methylphenyl)pent-3-en-2-one
CID 139494540

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-5-methylphenyl)ethanimidamide?
The IUPAC name of 2-(2-hydroxy-5-methylphenyl)ethanimidamide (CID 83676586) is 2-(2-hydroxy-5-methylphenyl)ethanimidamide.
What is the SMILES notation for 2-(2-hydroxy-5-methylphenyl)ethanimidamide?
The canonical SMILES for 2-(2-hydroxy-5-methylphenyl)ethanimidamide is [H]/N=C(\N)Cc1cc(C)ccc1O.
What is the InChIKey of 2-(2-hydroxy-5-methylphenyl)ethanimidamide?
The InChIKey is YGANGVGOCFSZML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-6-2-3-8(12)7(4-6)5-9(10)11/h2-4,12H,5H2,1H3,(H3,10,11).
What are the key properties of 2-(2-hydroxy-5-methylphenyl)ethanimidamide?
2-(2-hydroxy-5-methylphenyl)ethanimidamide has a molecular weight of 164.21 g/mol, XLogP of 1.18, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-5-methylphenyl)ethanimidamide is sourced from PubChem (CID 83676586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).