N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine

C19H25NO — CID 43694648

IUPACN-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine
SMILESCC(C)Oc1cccc(C(C)NCCc2ccccc2)c1
InChIInChI=1S/C19H25NO/c1-15(2)21-19-11-7-10-18(14-19)16(3)20-13-12-17-8-5-4-6-9-17/h4-11,14-16,20H,12-13H2,1-3H3
InChIKeyUXXAZLBDPKNQQC-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.37
Rot. Bonds7

About N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine

N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine (PubChem CID 43694648) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine.

Molecular Properties

Compound NameN-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine
PubChem CID43694648
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC NameN-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine
SMILESCC(C)Oc1cccc(C(C)NCCc2ccccc2)c1
InChIInChI=1S/C19H25NO/c1-15(2)21-19-11-7-10-18(14-19)16(3)20-13-12-17-8-5-4-6-9-17/h4-11,14-16,20H,12-13H2,1-3H3
InChIKeyUXXAZLBDPKNQQC-UHFFFAOYSA-N
XLogP4.37
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 ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-phenylethylamino)-2-(3-propan-2-yloxyphenyl)acetonitrile
CID 82020084
(1R)-1-(3-methylphenyl)-N-(2-phenylethyl)ethanamine
CID 81364217
N-[1-(3-methoxyphenyl)ethyl]-3-phenylpropan-1-amine
CID 18357750
N-[1-(3-propan-2-yloxyphenyl)ethyl]pentan-1-amine
CID 43694615
N-[(1S)-1-(3-methoxyphenyl)ethyl]-4-phenylbutan-1-amine
CID 104893847
3-[1-(2-phenylethylamino)ethyl]phenol
CID 43194109
1-[3-(difluoromethoxy)phenyl]-N-[2-(4-methoxyphenyl)ethyl]ethanamine
CID 112815867
[3-phenyl-1-(3-propan-2-yloxyphenyl)propyl]hydrazine
CID 105205731
N-[2-(4-fluorophenyl)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 43191768
2-[[1-(3-propan-2-yloxyphenyl)ethylamino]methyl]phenol
CID 43694661
N-methyl-N'-[1-[3-(3-phenylpropoxy)phenyl]ethyl]propane-1,3-diamine
CID 21422403
1-(1-bromo-2-phenylethyl)-3-propan-2-yloxybenzene
CID 63530049

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine?
The IUPAC name of N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine (CID 43694648) is N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine.
What is the SMILES notation for N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine?
The canonical SMILES for N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine is CC(C)Oc1cccc(C(C)NCCc2ccccc2)c1.
What is the InChIKey of N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine?
The InChIKey is UXXAZLBDPKNQQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-15(2)21-19-11-7-10-18(14-19)16(3)20-13-12-17-8-5-4-6-9-17/h4-11,14-16,20H,12-13H2,1-3H3.
What are the key properties of N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine?
N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine has a molecular weight of 283.42 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-1-(3-propan-2-yloxyphenyl)ethanamine is sourced from PubChem (CID 43694648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).