N'-(2-methylphenyl)-N-phenylmethanediamine

C14H16N2 — CID 14173164

IUPACN'-(2-methylphenyl)-N-phenylmethanediamine
SMILESCc1ccccc1NCNc1ccccc1
InChIInChI=1S/C14H16N2/c1-12-7-5-6-10-14(12)16-11-15-13-8-3-2-4-9-13/h2-10,15-16H,11H2,1H3
InChIKeyCSTHTSDXDYPOSC-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.48
Rot. Bonds4

About N'-(2-methylphenyl)-N-phenylmethanediamine

N'-(2-methylphenyl)-N-phenylmethanediamine (PubChem CID 14173164) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is N'-(2-methylphenyl)-N-phenylmethanediamine.

Molecular Properties

Compound NameN'-(2-methylphenyl)-N-phenylmethanediamine
PubChem CID14173164
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC NameN'-(2-methylphenyl)-N-phenylmethanediamine
SMILESCc1ccccc1NCNc1ccccc1
InChIInChI=1S/C14H16N2/c1-12-7-5-6-10-14(12)16-11-15-13-8-3-2-4-9-13/h2-10,15-16H,11H2,1H3
InChIKeyCSTHTSDXDYPOSC-UHFFFAOYSA-N
XLogP3.48
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

CID 175798397
CID 175798397
N,N'-diphenylmethanediamine;ethane-1,2-diol
CID 160711297
1-N-(anilinomethyl)-3-N-(ethoxymethyl)-4-methylbenzene-1,3-diamine
CID 142084222
3-(2-methylanilino)propan-1-ol
CID 18005925
N,N'-diphenylmethanediamine;2-methylbenzene-1,3-diamine
CID 88517859
2-(2-methylanilino)acetonitrile
CID 28018
N'-(4-iodophenyl)-N-phenylmethanediamine
CID 102159524
2-hydroxy-2-methyl-3-(2-methylanilino)propanoic acid
CID 104643822
1-N-methyl-2-N-[[2-(methylamino)anilino]methyl]benzene-1,2-diamine
CID 88866227
2-[(2-methylanilino)methyl]phenol
CID 3240149
N-(2-ethylbutyl)-2-methylaniline
CID 29290197
2-N-(anilinomethyl)-1-N-[(4-phenylsulfanylphenyl)methyl]benzene-1,2-diamine
CID 145055487

Frequently Asked Questions

What is the IUPAC name of N'-(2-methylphenyl)-N-phenylmethanediamine?
The IUPAC name of N'-(2-methylphenyl)-N-phenylmethanediamine (CID 14173164) is N'-(2-methylphenyl)-N-phenylmethanediamine.
What is the SMILES notation for N'-(2-methylphenyl)-N-phenylmethanediamine?
The canonical SMILES for N'-(2-methylphenyl)-N-phenylmethanediamine is Cc1ccccc1NCNc1ccccc1.
What is the InChIKey of N'-(2-methylphenyl)-N-phenylmethanediamine?
The InChIKey is CSTHTSDXDYPOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-12-7-5-6-10-14(12)16-11-15-13-8-3-2-4-9-13/h2-10,15-16H,11H2,1H3.
What are the key properties of N'-(2-methylphenyl)-N-phenylmethanediamine?
N'-(2-methylphenyl)-N-phenylmethanediamine has a molecular weight of 212.30 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methylphenyl)-N-phenylmethanediamine is sourced from PubChem (CID 14173164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).