N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine

C15H25NO — CID 3057528

IUPACN-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine
SMILESCCCN(CCC)CC(OC)c1ccccc1
InChIInChI=1S/C15H25NO/c1-4-11-16(12-5-2)13-15(17-3)14-9-7-6-8-10-14/h6-10,15H,4-5,11-13H2,1-3H3
InChIKeyATZYYSDRYFLPTD-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.50
Rot. Bonds8

About N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine

N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine (PubChem CID 3057528) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine.

Molecular Properties

Compound NameN-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine
PubChem CID3057528
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC NameN-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine
SMILESCCCN(CCC)CC(OC)c1ccccc1
InChIInChI=1S/C15H25NO/c1-4-11-16(12-5-2)13-15(17-3)14-9-7-6-8-10-14/h6-10,15H,4-5,11-13H2,1-3H3
InChIKeyATZYYSDRYFLPTD-UHFFFAOYSA-N
XLogP3.50
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-[(2R)-2-butan-2-yloxy-2-phenylethyl]-2-methoxy-N-[(2R)-2-methoxy-2-phenylethyl]-2-phenylethanamine
CID 146564671
N-ethyl-2-phenyl-N-propylpropan-1-amine
CID 143014369
N-[(2S)-2-methoxy-2-phenylethyl]-N-methylprop-1-en-2-amine
CID 156874668
benzene;[(1R)-1,2-dimethoxyethyl]benzene
CID 178156280
(2R)-2-methoxy-2-phenylethanol
CID 6950345
[(1S)-2-ethoxy-1-methoxyethyl]benzene
CID 155459528
1,2-bis(2-methoxy-2-phenylethyl)benzene
CID 90884874
dimethyl (E)-2-[butyl-(2-methoxy-2-phenylethyl)amino]but-2-enedioate
CID 102331028
3-[2-(dimethylamino)ethyl-propylamino]-2-phenylpropanenitrile
CID 64536346
2-(dipropylamino)-1-(4-phenylphenyl)ethanol
CID 82215884
2-[2-[bis[2-[bis[2-(2-hydroxyethoxy)-2-phenylethyl]amino]ethyl]amino]-1-phenylethoxy]ethanol
CID 59475402
(2-methoxy-2-phenylethyl) thiocyanate
CID 150744738

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine?
The IUPAC name of N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine (CID 3057528) is N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine.
What is the SMILES notation for N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine?
The canonical SMILES for N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine is CCCN(CCC)CC(OC)c1ccccc1.
What is the InChIKey of N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine?
The InChIKey is ATZYYSDRYFLPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-4-11-16(12-5-2)13-15(17-3)14-9-7-6-8-10-14/h6-10,15H,4-5,11-13H2,1-3H3.
What are the key properties of N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine?
N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine has a molecular weight of 235.37 g/mol, XLogP of 3.50, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-phenylethyl)-N-propylpropan-1-amine is sourced from PubChem (CID 3057528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).