N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine

C24H23N — CID 146334999

IUPACN-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine
SMILESCC(C)(C)Nc1ccc2ccccc2c1-c1cccc2ccccc12
InChIInChI=1S/C24H23N/c1-24(2,3)25-22-16-15-18-10-5-7-13-20(18)23(22)21-14-8-11-17-9-4-6-12-19(17)21/h4-16,25H,1-3H3
InChIKeyBVEJKSUABZDWKB-UHFFFAOYSA-N
MW325.46 g/mol
LogP6.87
Rot. Bonds2

About N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine

N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine (PubChem CID 146334999) has the molecular formula C24H23N and a molecular weight of 325.46 g/mol. Its IUPAC name is N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine.

Molecular Properties

Compound NameN-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine
PubChem CID146334999
Molecular FormulaC24H23N
Molecular Weight325.46 g/mol
Exact Mass325.18
IUPAC NameN-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine
SMILESCC(C)(C)Nc1ccc2ccccc2c1-c1cccc2ccccc12
InChIInChI=1S/C24H23N/c1-24(2,3)25-22-16-15-18-10-5-7-13-20(18)23(22)21-14-8-11-17-9-4-6-12-19(17)21/h4-16,25H,1-3H3
InChIKeyBVEJKSUABZDWKB-UHFFFAOYSA-N
XLogP6.87
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.46
LogP ≤ 56.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine?
The IUPAC name of N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine (CID 146334999) is N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine.
What is the SMILES notation for N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine?
The canonical SMILES for N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine is CC(C)(C)Nc1ccc2ccccc2c1-c1cccc2ccccc12.
What is the InChIKey of N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine?
The InChIKey is BVEJKSUABZDWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N/c1-24(2,3)25-22-16-15-18-10-5-7-13-20(18)23(22)21-14-8-11-17-9-4-6-12-19(17)21/h4-16,25H,1-3H3.
What are the key properties of N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine?
N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine has a molecular weight of 325.46 g/mol, XLogP of 6.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-naphthalen-1-ylnaphthalen-2-amine is sourced from PubChem (CID 146334999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).