1-benzhydryl-2,2-dimethylazetidin-3-amine

C18H22N2 — CID 10378262

IUPAC1-benzhydryl-2,2-dimethylazetidin-3-amine
SMILESCC1(C)C(N)CN1C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H22N2/c1-18(2)16(19)13-20(18)17(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16-17H,13,19H2,1-2H3
InChIKeyHAPPJJHFYIZSBO-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.20
Rot. Bonds3

About 1-benzhydryl-2,2-dimethylazetidin-3-amine

1-benzhydryl-2,2-dimethylazetidin-3-amine (PubChem CID 10378262) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-benzhydryl-2,2-dimethylazetidin-3-amine.

Molecular Properties

Compound Name1-benzhydryl-2,2-dimethylazetidin-3-amine
PubChem CID10378262
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name1-benzhydryl-2,2-dimethylazetidin-3-amine
SMILESCC1(C)C(N)CN1C(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H22N2/c1-18(2)16(19)13-20(18)17(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16-17H,13,19H2,1-2H3
InChIKeyHAPPJJHFYIZSBO-UHFFFAOYSA-N
XLogP3.20
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-benzhydryl-2,2-dimethylazetidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-benzhydryl-2,2-dimethylazetidin-3-amine?
The IUPAC name of 1-benzhydryl-2,2-dimethylazetidin-3-amine (CID 10378262) is 1-benzhydryl-2,2-dimethylazetidin-3-amine.
What is the SMILES notation for 1-benzhydryl-2,2-dimethylazetidin-3-amine?
The canonical SMILES for 1-benzhydryl-2,2-dimethylazetidin-3-amine is CC1(C)C(N)CN1C(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-benzhydryl-2,2-dimethylazetidin-3-amine?
The InChIKey is HAPPJJHFYIZSBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-18(2)16(19)13-20(18)17(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16-17H,13,19H2,1-2H3.
What are the key properties of 1-benzhydryl-2,2-dimethylazetidin-3-amine?
1-benzhydryl-2,2-dimethylazetidin-3-amine has a molecular weight of 266.39 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzhydryl-2,2-dimethylazetidin-3-amine is sourced from PubChem (CID 10378262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).