1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine

C15H18N2O — CID 104736678

IUPAC1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine
SMILESCOc1ccc(C(N)Cc2cccnc2)cc1C
InChIInChI=1S/C15H18N2O/c1-11-8-13(5-6-15(11)18-2)14(16)9-12-4-3-7-17-10-12/h3-8,10,14H,9,16H2,1-2H3
InChIKeyGOYVITHZXKYISR-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.64
Rot. Bonds4

About 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine

1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine (PubChem CID 104736678) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine
PubChem CID104736678
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine
SMILESCOc1ccc(C(N)Cc2cccnc2)cc1C
InChIInChI=1S/C15H18N2O/c1-11-8-13(5-6-15(11)18-2)14(16)9-12-4-3-7-17-10-12/h3-8,10,14H,9,16H2,1-2H3
InChIKeyGOYVITHZXKYISR-UHFFFAOYSA-N
XLogP2.64
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-bromo-4-methoxyphenyl)-2-pyridin-3-ylethanamine
CID 105034619
(1S)-1-(4-methoxy-3-methylphenyl)ethane-1,2-diamine
CID 55278362
2-(3-methoxyphenyl)-1-pyridin-3-ylethanamine
CID 22299530
2-(3,4-dimethylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 83972735
1,1-bis(4-methoxy-3-methylphenyl)-3-phenylpropan-2-amine
CID 91059211
1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine
CID 105034568
2-[3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]-1-pyridin-3-ylethanamine
CID 21148418
2-(5-bromo-3-pyridinyl)-1-(3-methoxy-4-methylphenyl)ethanamine
CID 105036758
1-(2,4-dimethylphenyl)-2-pyridin-3-ylethanamine
CID 62802997
1-(3,4-dimethylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 62549735
2-(3-chloro-4-pyridinyl)-1-(3-methoxy-4-methylphenyl)ethanamine
CID 112655524
1-(2-methoxy-5-methylphenyl)-N-methyl-2-pyridin-3-ylethanamine
CID 62794931

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine?
The IUPAC name of 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine (CID 104736678) is 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine is COc1ccc(C(N)Cc2cccnc2)cc1C.
What is the InChIKey of 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine?
The InChIKey is GOYVITHZXKYISR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-8-13(5-6-15(11)18-2)14(16)9-12-4-3-7-17-10-12/h3-8,10,14H,9,16H2,1-2H3.
What are the key properties of 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine?
1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine has a molecular weight of 242.32 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine is sourced from PubChem (CID 104736678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).