N-(2,2,3-trimethylbutyl)naphthalen-2-amine

C17H23N — CID 114100780

IUPACN-(2,2,3-trimethylbutyl)naphthalen-2-amine
SMILESCC(C)C(C)(C)CNc1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-13(2)17(3,4)12-18-16-10-9-14-7-5-6-8-15(14)11-16/h5-11,13,18H,12H2,1-4H3
InChIKeyXDURIDFITVQNBA-UHFFFAOYSA-N
MW241.38 g/mol
LogP4.93
Rot. Bonds4

About N-(2,2,3-trimethylbutyl)naphthalen-2-amine

N-(2,2,3-trimethylbutyl)naphthalen-2-amine (PubChem CID 114100780) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is N-(2,2,3-trimethylbutyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-(2,2,3-trimethylbutyl)naphthalen-2-amine
PubChem CID114100780
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC NameN-(2,2,3-trimethylbutyl)naphthalen-2-amine
SMILESCC(C)C(C)(C)CNc1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-13(2)17(3,4)12-18-16-10-9-14-7-5-6-8-15(14)11-16/h5-11,13,18H,12H2,1-4H3
InChIKeyXDURIDFITVQNBA-UHFFFAOYSA-N
XLogP4.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol
CID 106294557
2,2-difluoro-3-(naphthalen-2-ylamino)propan-1-ol
CID 106177968
N-tert-butylnaphthalen-2-amine
CID 13200783
2-(naphthalen-2-ylamino)acetonitrile
CID 43420244
2-(naphthalen-2-ylamino)-N-propan-2-ylacetamide
CID 43398270
N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine
CID 43680210
N'-methyl-N-naphthalen-2-yl-N'-propan-2-ylpropane-1,3-diamine
CID 106048462
N-(3-hydroxy-2,2,4-trimethylpentyl)-N'-naphthalen-2-yloxamide
CID 109389475
N',N'-dimethyl-N-naphthalen-2-ylethane-1,2-diamine
CID 43401306
3-ethyl-1-(naphthalen-2-ylamino)pentan-2-ol
CID 106287465
N-hexadecylnaphthalen-2-amine
CID 12796089
N-(2-hydroxy-2,3-dimethylbutyl)-2-naphthalen-2-yloxyacetamide
CID 111483554

Frequently Asked Questions

What is the IUPAC name of N-(2,2,3-trimethylbutyl)naphthalen-2-amine?
The IUPAC name of N-(2,2,3-trimethylbutyl)naphthalen-2-amine (CID 114100780) is N-(2,2,3-trimethylbutyl)naphthalen-2-amine.
What is the SMILES notation for N-(2,2,3-trimethylbutyl)naphthalen-2-amine?
The canonical SMILES for N-(2,2,3-trimethylbutyl)naphthalen-2-amine is CC(C)C(C)(C)CNc1ccc2ccccc2c1.
What is the InChIKey of N-(2,2,3-trimethylbutyl)naphthalen-2-amine?
The InChIKey is XDURIDFITVQNBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-13(2)17(3,4)12-18-16-10-9-14-7-5-6-8-15(14)11-16/h5-11,13,18H,12H2,1-4H3.
What are the key properties of N-(2,2,3-trimethylbutyl)naphthalen-2-amine?
N-(2,2,3-trimethylbutyl)naphthalen-2-amine has a molecular weight of 241.38 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,3-trimethylbutyl)naphthalen-2-amine is sourced from PubChem (CID 114100780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).