N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine

C17H23NO — CID 43505535

IUPACN-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine
SMILESCCNCc1c(OC(C)CC)ccc2ccccc12
InChIInChI=1S/C17H23NO/c1-4-13(3)19-17-11-10-14-8-6-7-9-15(14)16(17)12-18-5-2/h6-11,13,18H,4-5,12H2,1-3H3
InChIKeyBZBARLGPPPBFKO-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.13
Rot. Bonds6

About N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine

N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine (PubChem CID 43505535) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine
PubChem CID43505535
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC NameN-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine
SMILESCCNCc1c(OC(C)CC)ccc2ccccc12
InChIInChI=1S/C17H23NO/c1-4-13(3)19-17-11-10-14-8-6-7-9-15(14)16(17)12-18-5-2/h6-11,13,18H,4-5,12H2,1-3H3
InChIKeyBZBARLGPPPBFKO-UHFFFAOYSA-N
XLogP4.13
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine with MolForge

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

Launch Full Analysis

Related Compounds

N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]prop-2-en-1-amine
CID 54849945
N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]-1-(4-propan-2-yloxyphenyl)methanamine
CID 54848695
N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]-3-phenylpropan-1-amine
CID 54804530
N-[[2-(2-ethylbutoxy)naphthalen-1-yl]methyl]ethanamine
CID 82926082
(2R)-1-[(2-propan-2-yloxynaphthalen-1-yl)methylamino]propan-2-ol
CID 51996892
N-[[2-[(2R)-butan-2-yl]oxyphenyl]methyl]ethanamine
CID 92983672
N-[(2-methoxynaphthalen-1-yl)methyl]-2-methylbutan-1-amine
CID 62693267
N-[[2-[(2-chlorophenyl)methoxy]naphthalen-1-yl]methyl]ethanamine
CID 4716502
N,N'-bis[(2-propan-2-yloxynaphthalen-1-yl)methyl]hexane-1,6-diamine;methanesulfonic acid
CID 44531928
N-[[2-(2-phenylethoxy)naphthalen-1-yl]methyl]ethanamine
CID 54804704
2-[1-(ethylaminomethyl)naphthalen-2-yl]oxy-N,N-dimethylethanamine
CID 39290120
N-[(2-but-2-ynoxynaphthalen-1-yl)methyl]ethanamine
CID 62311911

Frequently Asked Questions

What is the IUPAC name of N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine?
The IUPAC name of N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine (CID 43505535) is N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine.
What is the SMILES notation for N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine?
The canonical SMILES for N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine is CCNCc1c(OC(C)CC)ccc2ccccc12.
What is the InChIKey of N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine?
The InChIKey is BZBARLGPPPBFKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-4-13(3)19-17-11-10-14-8-6-7-9-15(14)16(17)12-18-5-2/h6-11,13,18H,4-5,12H2,1-3H3.
What are the key properties of N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine?
N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine has a molecular weight of 257.38 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-butan-2-yloxynaphthalen-1-yl)methyl]ethanamine is sourced from PubChem (CID 43505535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).