2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride

C19H25ClN2 — CID 23723121

IUPAC2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride
SMILESCc1cccc(C)c1/C(=N/CCN(C)C)c1ccccc1.Cl
InChIInChI=1S/C19H24N2.ClH/c1-15-9-8-10-16(2)18(15)19(20-13-14-21(3)4)17-11-6-5-7-12-17;/h5-12H,13-14H2,1-4H3;1H/b20-19+;
InChIKeySYZVXYVWEXVXBQ-RZLHGTIFSA-N
MW316.88 g/mol
LogP4.12
Rot. Bonds5

About 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride

2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride (PubChem CID 23723121) has the molecular formula C19H25ClN2 and a molecular weight of 316.88 g/mol. Its IUPAC name is 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride.

Molecular Properties

Compound Name2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride
PubChem CID23723121
Molecular FormulaC19H25ClN2
Molecular Weight316.88 g/mol
Exact Mass316.17
IUPAC Name2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride
SMILESCc1cccc(C)c1/C(=N/CCN(C)C)c1ccccc1.Cl
InChIInChI=1S/C19H24N2.ClH/c1-15-9-8-10-16(2)18(15)19(20-13-14-21(3)4)17-11-6-5-7-12-17;/h5-12H,13-14H2,1-4H3;1H/b20-19+;
InChIKeySYZVXYVWEXVXBQ-RZLHGTIFSA-N
XLogP4.12
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.88
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride?
The IUPAC name of 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride (CID 23723121) is 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride.
What is the SMILES notation for 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride?
The canonical SMILES for 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride is Cc1cccc(C)c1/C(=N/CCN(C)C)c1ccccc1.Cl.
What is the InChIKey of 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride?
The InChIKey is SYZVXYVWEXVXBQ-RZLHGTIFSA-N. The full InChI is InChI=1S/C19H24N2.ClH/c1-15-9-8-10-16(2)18(15)19(20-13-14-21(3)4)17-11-6-5-7-12-17;/h5-12H,13-14H2,1-4H3;1H/b20-19+;.
What are the key properties of 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride?
2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride has a molecular weight of 316.88 g/mol, XLogP of 4.12, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2,6-dimethylphenyl)-phenylmethylidene]amino]-N,N-dimethylethanamine;hydrochloride is sourced from PubChem (CID 23723121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).