3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine

C19H25NO — CID 64852908

IUPAC3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine
SMILESCCOC1CC(NCc2cccc3ccccc23)C1(C)C
InChIInChI=1S/C19H25NO/c1-4-21-18-12-17(19(18,2)3)20-13-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,17-18,20H,4,12-13H2,1-3H3
InChIKeyCFCCHWZXIWNFDP-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.13
Rot. Bonds5

About 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine

3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine (PubChem CID 64852908) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine
PubChem CID64852908
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine
SMILESCCOC1CC(NCc2cccc3ccccc23)C1(C)C
InChIInChI=1S/C19H25NO/c1-4-21-18-12-17(19(18,2)3)20-13-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,17-18,20H,4,12-13H2,1-3H3
InChIKeyCFCCHWZXIWNFDP-UHFFFAOYSA-N
XLogP4.13
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethoxy-N-[(4-methoxyphenyl)methyl]-2,2-dimethylcyclobutan-1-amine
CID 64687156
3-ethoxy-2,2-dimethyl-N-[2-(2-methylphenyl)ethyl]cyclobutan-1-amine
CID 79763220
2-[[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]methyl]phenol
CID 115642851
N-(3-ethoxy-2,2-dimethylcyclobutyl)-2-ethylaniline
CID 64852282
2,2,5,5-tetramethyl-N-(naphthalen-1-ylmethyl)oxolan-3-amine
CID 79911054
3-ethoxy-2,2-dimethyl-N-[(4-propan-2-ylphenyl)methyl]cyclobutan-1-amine
CID 64850958
3-ethoxy-2,2-dimethyl-N-[(3-methyl-2-pyridinyl)methyl]cyclobutan-1-amine
CID 64852721
3-ethoxy-N-[(2-ethylphenyl)methyl]spiro[3.3]heptan-1-amine
CID 65294485
3-ethoxy-2,2-dimethyl-N-(2-phenylprop-2-enyl)cyclobutan-1-amine
CID 103921124
1-(2-chlorophenyl)-2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethanol
CID 103921901
N-[(2-chlorophenyl)methyl]-3-ethoxyspiro[3.3]heptan-1-amine
CID 65295569
cis-(1R,3S)-3-ethoxy-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 95241171

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine?
The IUPAC name of 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine (CID 64852908) is 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine.
What is the SMILES notation for 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine?
The canonical SMILES for 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine is CCOC1CC(NCc2cccc3ccccc23)C1(C)C.
What is the InChIKey of 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine?
The InChIKey is CFCCHWZXIWNFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-4-21-18-12-17(19(18,2)3)20-13-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,17-18,20H,4,12-13H2,1-3H3.
What are the key properties of 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine?
3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2,2-dimethyl-N-(naphthalen-1-ylmethyl)cyclobutan-1-amine is sourced from PubChem (CID 64852908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).