N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine

C19H23N — CID 81422447

IUPACN,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine
SMILESCNC1C(c2ccccc2)C(c2ccccc2)C1(C)C
InChIInChI=1S/C19H23N/c1-19(2)17(15-12-8-5-9-13-15)16(18(19)20-3)14-10-6-4-7-11-14/h4-13,16-18,20H,1-3H3
InChIKeyLIEJEGSRDNDERK-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.18
Rot. Bonds3

About N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine

N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine (PubChem CID 81422447) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine
PubChem CID81422447
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC NameN,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine
SMILESCNC1C(c2ccccc2)C(c2ccccc2)C1(C)C
InChIInChI=1S/C19H23N/c1-19(2)17(15-12-8-5-9-13-15)16(18(19)20-3)14-10-6-4-7-11-14/h4-13,16-18,20H,1-3H3
InChIKeyLIEJEGSRDNDERK-UHFFFAOYSA-N
XLogP4.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine?
The IUPAC name of N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine (CID 81422447) is N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine?
The canonical SMILES for N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine is CNC1C(c2ccccc2)C(c2ccccc2)C1(C)C.
What is the InChIKey of N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine?
The InChIKey is LIEJEGSRDNDERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-19(2)17(15-12-8-5-9-13-15)16(18(19)20-3)14-10-6-4-7-11-14/h4-13,16-18,20H,1-3H3.
What are the key properties of N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine?
N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3,4-diphenylcyclobutan-1-amine is sourced from PubChem (CID 81422447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).