2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine

C16H25NO — CID 106201059

IUPAC2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine
SMILESCCC(OCCC1CCC1)C(N)c1ccccc1
InChIInChI=1S/C16H25NO/c1-2-15(18-12-11-13-7-6-8-13)16(17)14-9-4-3-5-10-14/h3-5,9-10,13,15-16H,2,6-8,11-12,17H2,1H3
InChIKeyRPKFAKPGNYILRR-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.67
Rot. Bonds7

About 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine

2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine (PubChem CID 106201059) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine.

Molecular Properties

Compound Name2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine
PubChem CID106201059
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine
SMILESCCC(OCCC1CCC1)C(N)c1ccccc1
InChIInChI=1S/C16H25NO/c1-2-15(18-12-11-13-7-6-8-13)16(17)14-9-4-3-5-10-14/h3-5,9-10,13,15-16H,2,6-8,11-12,17H2,1H3
InChIKeyRPKFAKPGNYILRR-UHFFFAOYSA-N
XLogP3.67
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-(2-propan-2-yloxyethoxy)butan-1-amine
CID 43211618
2-(2-butoxyethoxy)-1-phenylbutan-1-amine
CID 43127531
2-(2-cyclopropylethoxy)-N-methyl-1-phenylbutan-1-amine
CID 106200514
2-methoxy-1-phenylbutan-1-amine
CID 43211581
1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine
CID 106200053
1-(2-cyclobutylethoxy)-1-(4-methylphenyl)butan-2-amine
CID 106200131
2-(2-cyclopropylethoxy)-N-ethyl-2-phenylethanamine
CID 106204975
N-[2-(2-cyclobutylethoxy)-2-phenylethyl]cyclopropanamine
CID 106205044
1-(3-cyclobutylphenyl)-2-ethoxybutan-1-amine
CID 114604686
2-phenoxy-1-phenylbutan-1-amine
CID 43211594
2-cyclopropylethyl (2S)-2-amino-2-phenylacetate
CID 106202488
1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine
CID 106200095

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine?
The IUPAC name of 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine (CID 106201059) is 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine.
What is the SMILES notation for 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine?
The canonical SMILES for 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine is CCC(OCCC1CCC1)C(N)c1ccccc1.
What is the InChIKey of 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine?
The InChIKey is RPKFAKPGNYILRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-2-15(18-12-11-13-7-6-8-13)16(17)14-9-4-3-5-10-14/h3-5,9-10,13,15-16H,2,6-8,11-12,17H2,1H3.
What are the key properties of 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine?
2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine has a molecular weight of 247.38 g/mol, XLogP of 3.67, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine is sourced from PubChem (CID 106201059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).