3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine

C15H18N2O — CID 170878546

IUPAC3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine
SMILESCOc1ccc(-c2cccc(CCCN)n2)cc1
InChIInChI=1S/C15H18N2O/c1-18-14-9-7-12(8-10-14)15-6-2-4-13(17-15)5-3-11-16/h2,4,6-10H,3,5,11,16H2,1H3
InChIKeyVXEHLBGWMIMARD-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.65
Rot. Bonds5

About 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine

3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine (PubChem CID 170878546) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine
PubChem CID170878546
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine
SMILESCOc1ccc(-c2cccc(CCCN)n2)cc1
InChIInChI=1S/C15H18N2O/c1-18-14-9-7-12(8-10-14)15-6-2-4-13(17-15)5-3-11-16/h2,4,6-10H,3,5,11,16H2,1H3
InChIKeyVXEHLBGWMIMARD-UHFFFAOYSA-N
XLogP2.65
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(4-chlorophenyl)-2-pyridinyl]ethanamine
CID 83713592
3-(4-methoxyphenyl)propan-1-amine;hydrochloride
CID 3029814
3-[2-(4-methoxyphenyl)-1H-imidazol-5-yl]propan-1-amine
CID 82463568
4-[4-(4-methoxyphenyl)imidazol-1-yl]butan-1-amine
CID 18694797
3-[1-[2-(4-methoxyphenyl)ethyl]triazol-4-yl]propan-1-amine
CID 106220877
4-(7-methoxy-4-methylquinolin-2-yl)butan-1-amine
CID 82577735
4-(4-methoxyphenyl)butan-1-amine;hydrochloride
CID 22715047
5-(4-methoxyphenyl)pentan-1-amine
CID 11507342
10-(4-methoxyphenyl)decan-1-amine
CID 70566558
3-(5-methoxyimidazo[1,2-a]pyridin-2-yl)propan-1-amine
CID 115024111
3-[[4-(4-methoxyphenyl)-6-pyridin-2-yl-2-pyridinyl]oxy]propan-1-amine
CID 11099738
3-(3-aminopropyl)-6-(4-methoxyphenyl)-2-methylpyrimidin-4-one
CID 82105226

Frequently Asked Questions

What is the IUPAC name of 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine?
The IUPAC name of 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine (CID 170878546) is 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine?
The canonical SMILES for 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine is COc1ccc(-c2cccc(CCCN)n2)cc1.
What is the InChIKey of 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine?
The InChIKey is VXEHLBGWMIMARD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-18-14-9-7-12(8-10-14)15-6-2-4-13(17-15)5-3-11-16/h2,4,6-10H,3,5,11,16H2,1H3.
What are the key properties of 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine?
3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine has a molecular weight of 242.32 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(4-methoxyphenyl)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 170878546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).