2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine

C19H25NO — CID 62449487

IUPAC2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine
SMILESCCC(CNC(C)C)Oc1ccccc1-c1ccccc1
InChIInChI=1S/C19H25NO/c1-4-17(14-20-15(2)3)21-19-13-9-8-12-18(19)16-10-6-5-7-11-16/h5-13,15,17,20H,4,14H2,1-3H3
InChIKeyOJFWNDBUWIQTIB-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.51
Rot. Bonds7

About 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine

2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine (PubChem CID 62449487) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine.

Molecular Properties

Compound Name2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine
PubChem CID62449487
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine
SMILESCCC(CNC(C)C)Oc1ccccc1-c1ccccc1
InChIInChI=1S/C19H25NO/c1-4-17(14-20-15(2)3)21-19-13-9-8-12-18(19)16-10-6-5-7-11-16/h5-13,15,17,20H,4,14H2,1-3H3
InChIKeyOJFWNDBUWIQTIB-UHFFFAOYSA-N
XLogP4.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-phenylphenoxy)pentanenitrile
CID 43367670
2-(2,3-dichlorophenoxy)-N-propan-2-ylbutan-1-amine
CID 62451787
2-(2,6-dimethoxyphenoxy)-N-propan-2-ylbutan-1-amine
CID 62450533
N'-hydroxy-3-(2-phenylphenoxy)pentanimidamide
CID 43175259
N-butan-2-yl-2-(2-methylphenoxy)butan-1-amine
CID 46736333
3-(2-phenylphenoxy)-N-propan-2-ylpropan-1-amine
CID 29016000
2-phenylmethoxy-N-propan-2-ylbutan-1-amine
CID 62446151
2-(2-methylphenoxy)-N-propan-2-ylpentan-1-amine
CID 83045581
1-[(2S)-2-methylbutoxy]-2-phenylbenzene
CID 57221058
1-[(E)-hex-3-en-2-yl]oxy-2-phenylbenzene
CID 23726770
2-(2-phenylethoxy)-N-propan-2-ylbutan-1-amine
CID 115002161
2-(2-methoxy-4-methylphenoxy)-N-propan-2-ylbutan-1-amine
CID 62452119

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine?
The IUPAC name of 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine (CID 62449487) is 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine.
What is the SMILES notation for 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine?
The canonical SMILES for 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine is CCC(CNC(C)C)Oc1ccccc1-c1ccccc1.
What is the InChIKey of 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine?
The InChIKey is OJFWNDBUWIQTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-4-17(14-20-15(2)3)21-19-13-9-8-12-18(19)16-10-6-5-7-11-16/h5-13,15,17,20H,4,14H2,1-3H3.
What are the key properties of 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine?
2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.51, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylphenoxy)-N-propan-2-ylbutan-1-amine is sourced from PubChem (CID 62449487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).