N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine

C10H14N2 — CID 155067915

IUPACN-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine
SMILESC/C=N\NCc1cccc(C)c1
InChIInChI=1S/C10H14N2/c1-3-11-12-8-10-6-4-5-9(2)7-10/h3-7,12H,8H2,1-2H3/b11-3-
InChIKeyIRWDCEWTGCCKGA-JYOAFUTRSA-N
MW162.24 g/mol
LogP2.09
Rot. Bonds3

About N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine

N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine (PubChem CID 155067915) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine.

Molecular Properties

Compound NameN-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine
PubChem CID155067915
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine
SMILESC/C=N\NCc1cccc(C)c1
InChIInChI=1S/C10H14N2/c1-3-11-12-8-10-6-4-5-9(2)7-10/h3-7,12H,8H2,1-2H3/b11-3-
InChIKeyIRWDCEWTGCCKGA-JYOAFUTRSA-N
XLogP2.09
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methyl-1-[3-[2-(3-methylphenyl)ethyl]phenyl]methanamine
CID 145495304
ethane;N-[(Z)-ethylideneamino]-3-methylaniline
CID 142906604
1-(3-chlorophenyl)-N-[(3-methylphenyl)methyl]methanamine
CID 28664098
ethane;methanamine;2-[(3-methylphenyl)methylamino]acetaldehyde
CID 143498965
N"-[(3-methylphenyl)methyl]methanetriamine
CID 144552123
2-(3-methylphenyl)-N-[(3-methylphenyl)methyl]ethanamine
CID 55062468
1-ethyl-3-methylbenzene;methanamine
CID 167447790
N-[(3-methylphenyl)methyl]-1H-pyrazol-4-amine
CID 43540108
2-bromo-N-[(3-methylphenyl)methyl]acetamide
CID 63679307
ethene;N-[(3-methylphenyl)methyl]aniline;molecular hydrogen
CID 168878317
N-[(3-methylphenyl)methyl]cyclopropanamine
CID 16776498
3-chloro-2,2-dimethyl-N-[(3-methylphenyl)methyl]propanamide
CID 63680580

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine?
The IUPAC name of N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine (CID 155067915) is N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine.
What is the SMILES notation for N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine?
The canonical SMILES for N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine is C/C=N\NCc1cccc(C)c1.
What is the InChIKey of N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine?
The InChIKey is IRWDCEWTGCCKGA-JYOAFUTRSA-N. The full InChI is InChI=1S/C10H14N2/c1-3-11-12-8-10-6-4-5-9(2)7-10/h3-7,12H,8H2,1-2H3/b11-3-.
What are the key properties of N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine?
N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine has a molecular weight of 162.24 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-ethylideneamino]-1-(3-methylphenyl)methanamine is sourced from PubChem (CID 155067915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).