2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine

C18H22N2O — CID 116517771

IUPAC2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine
SMILESCNC(Cc1ccc(OC)nc1)C1CC1c1ccccc1
InChIInChI=1S/C18H22N2O/c1-19-17(10-13-8-9-18(21-2)20-12-13)16-11-15(16)14-6-4-3-5-7-14/h3-9,12,15-17,19H,10-11H2,1-2H3
InChIKeyBPKPXIQRXPTBPC-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.02
Rot. Bonds6

About 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine

2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine (PubChem CID 116517771) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine.

Molecular Properties

Compound Name2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine
PubChem CID116517771
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine
SMILESCNC(Cc1ccc(OC)nc1)C1CC1c1ccccc1
InChIInChI=1S/C18H22N2O/c1-19-17(10-13-8-9-18(21-2)20-12-13)16-11-15(16)14-6-4-3-5-7-14/h3-9,12,15-17,19H,10-11H2,1-2H3
InChIKeyBPKPXIQRXPTBPC-UHFFFAOYSA-N
XLogP3.02
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-phenoxy-1-(2-phenylcyclopropyl)ethanamine
CID 116517453
[2-(4-methoxyphenyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105205565
3-methoxy-N,3-dimethyl-1-(2-phenylcyclopropyl)butan-1-amine
CID 103029487
[1-cyclohexyl-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250515
1-cyclopropyl-N-[(6-methoxy-3-pyridinyl)methyl]-1-phenylmethanamine
CID 61311987
[1-cyclobutyl-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250610
3-ethyl-N-methyl-1-(2-phenylcyclopropyl)pentan-1-amine
CID 105028477
2-methoxy-N,2-dimethyl-1-(2-phenylcyclopropyl)propan-1-amine
CID 116517722
[2-(1-methylpyrazol-4-yl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105291195
[1-(2-bromophenyl)-3-(6-methoxy-3-pyridinyl)propan-2-yl]hydrazine
CID 105250637
(1R)-N-[(6-methoxy-3-pyridinyl)methyl]-1-phenylethanamine
CID 28712228
(1S)-N-[(6-methoxy-3-pyridinyl)methyl]-1-phenylethanamine
CID 28712225

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine?
The IUPAC name of 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine (CID 116517771) is 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine.
What is the SMILES notation for 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine?
The canonical SMILES for 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine is CNC(Cc1ccc(OC)nc1)C1CC1c1ccccc1.
What is the InChIKey of 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine?
The InChIKey is BPKPXIQRXPTBPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-19-17(10-13-8-9-18(21-2)20-12-13)16-11-15(16)14-6-4-3-5-7-14/h3-9,12,15-17,19H,10-11H2,1-2H3.
What are the key properties of 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine?
2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine has a molecular weight of 282.39 g/mol, XLogP of 3.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-3-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)ethanamine is sourced from PubChem (CID 116517771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).