N-benzhydryl-2-methylpropan-1-imine

C17H19N — CID 10657527

IUPACN-benzhydryl-2-methylpropan-1-imine
SMILESCC(C)/C=N/C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N/c1-14(2)13-18-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-14,17H,1-2H3/b18-13+
InChIKeyNOYUXBZUSVICGL-QGOAFFKASA-N
MW237.35 g/mol
LogP4.50
Rot. Bonds4

About N-benzhydryl-2-methylpropan-1-imine

N-benzhydryl-2-methylpropan-1-imine (PubChem CID 10657527) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is N-benzhydryl-2-methylpropan-1-imine.

Molecular Properties

Compound NameN-benzhydryl-2-methylpropan-1-imine
PubChem CID10657527
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC NameN-benzhydryl-2-methylpropan-1-imine
SMILESCC(C)/C=N/C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N/c1-14(2)13-18-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-14,17H,1-2H3/b18-13+
InChIKeyNOYUXBZUSVICGL-QGOAFFKASA-N
XLogP4.50
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 N-benzhydryl-2-methylpropan-1-imine?
The IUPAC name of N-benzhydryl-2-methylpropan-1-imine (CID 10657527) is N-benzhydryl-2-methylpropan-1-imine.
What is the SMILES notation for N-benzhydryl-2-methylpropan-1-imine?
The canonical SMILES for N-benzhydryl-2-methylpropan-1-imine is CC(C)/C=N/C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-benzhydryl-2-methylpropan-1-imine?
The InChIKey is NOYUXBZUSVICGL-QGOAFFKASA-N. The full InChI is InChI=1S/C17H19N/c1-14(2)13-18-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-14,17H,1-2H3/b18-13+.
What are the key properties of N-benzhydryl-2-methylpropan-1-imine?
N-benzhydryl-2-methylpropan-1-imine has a molecular weight of 237.35 g/mol, XLogP of 4.50, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-2-methylpropan-1-imine is sourced from PubChem (CID 10657527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).