1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine

C19H25NO — CID 63473996

IUPAC1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine
SMILESCCc1ccc(C(NC)C(C)Oc2cccc(C)c2)cc1
InChIInChI=1S/C19H25NO/c1-5-16-9-11-17(12-10-16)19(20-4)15(3)21-18-8-6-7-14(2)13-18/h6-13,15,19-20H,5H2,1-4H3
InChIKeyOZSKPGSOLUQRTN-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.29
Rot. Bonds6

About 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine

1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine (PubChem CID 63473996) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine.

Molecular Properties

Compound Name1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine
PubChem CID63473996
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine
SMILESCCc1ccc(C(NC)C(C)Oc2cccc(C)c2)cc1
InChIInChI=1S/C19H25NO/c1-5-16-9-11-17(12-10-16)19(20-4)15(3)21-18-8-6-7-14(2)13-18/h6-13,15,19-20H,5H2,1-4H3
InChIKeyOZSKPGSOLUQRTN-UHFFFAOYSA-N
XLogP4.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-(methoxymethyl)phenoxy]-N-methyl-1-phenylpropan-1-amine
CID 63984967
1-ethyl-4-(3-methylphenoxy)benzene
CID 54200256
1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine
CID 116948027
1-(4-ethylphenyl)-N-methyl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine
CID 66275433
(2R)-N-[(Z)-(4-ethylphenyl)methylideneamino]-2-(3-methylphenoxy)propanamide
CID 5397085
1-(4-ethylphenyl)-N-methyl-2-[(3-methylphenyl)methylsulfanyl]ethanamine
CID 64634181
N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine
CID 43491470
(1R)-N-[(4-ethylphenyl)methyl]-1-(3-methylphenyl)ethanamine
CID 81364360
(1S)-N-[(4-ethylphenyl)methyl]-1-(3-methylphenyl)ethanamine
CID 81361545
2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine
CID 105099609
1-(4-ethylphenyl)-N-[2-(3-methylphenyl)ethyl]ethanamine
CID 63477985
1-methyl-3-(1-phenylethoxy)benzene
CID 64765647

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine?
The IUPAC name of 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine (CID 63473996) is 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine.
What is the SMILES notation for 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine?
The canonical SMILES for 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine is CCc1ccc(C(NC)C(C)Oc2cccc(C)c2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine?
The InChIKey is OZSKPGSOLUQRTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-5-16-9-11-17(12-10-16)19(20-4)15(3)21-18-8-6-7-14(2)13-18/h6-13,15,19-20H,5H2,1-4H3.
What are the key properties of 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine?
1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-N-methyl-2-(3-methylphenoxy)propan-1-amine is sourced from PubChem (CID 63473996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).