N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine

C18H24N2O — CID 115605108

IUPACN-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine
SMILESCCCc1ccc(C(NCC)c2cccnc2OC)cc1
InChIInChI=1S/C18H24N2O/c1-4-7-14-9-11-15(12-10-14)17(19-5-2)16-8-6-13-20-18(16)21-3/h6,8-13,17,19H,4-5,7H2,1-3H3
InChIKeyNISMXEKIUSGYFD-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.74
Rot. Bonds7

About N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine

N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine (PubChem CID 115605108) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine
PubChem CID115605108
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine
SMILESCCCc1ccc(C(NCC)c2cccnc2OC)cc1
InChIInChI=1S/C18H24N2O/c1-4-7-14-9-11-15(12-10-14)17(19-5-2)16-8-6-13-20-18(16)21-3/h6,8-13,17,19H,4-5,7H2,1-3H3
InChIKeyNISMXEKIUSGYFD-UHFFFAOYSA-N
XLogP3.74
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chloro-3-methoxyphenyl)-(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 105164557
N-[(3,4-difluorophenyl)-(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 115605106
N-[(1-ethylpyrazol-4-yl)-(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 105109075
N-ethyl-1-(2-methoxy-3-pyridinyl)-3-phenylpropan-1-amine
CID 105094165
N-[(3-chloro-4-methylphenyl)-(2-methoxy-3-pyridinyl)methyl]propan-1-amine
CID 107561571
N-[(2-methoxy-3-pyridinyl)-(2,3,4-trifluorophenyl)methyl]ethanamine
CID 105146502
N-[(4-ethylphenyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 104515338
N-[(2-methoxy-3-pyridinyl)-(3-methylphenyl)methyl]propan-1-amine
CID 105090915
[(2-methoxy-3-pyridinyl)-(4-methylphenyl)methyl]hydrazine
CID 105285352
N-[(4-bromo-1-methylpyrazol-5-yl)-(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 105189806
N-[(5-bromo-3-methyltriazol-4-yl)-(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 106464806
N-[(6-methyl-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine
CID 105144382

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine?
The IUPAC name of N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine (CID 115605108) is N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine?
The canonical SMILES for N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine is CCCc1ccc(C(NCC)c2cccnc2OC)cc1.
What is the InChIKey of N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine?
The InChIKey is NISMXEKIUSGYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-4-7-14-9-11-15(12-10-14)17(19-5-2)16-8-6-13-20-18(16)21-3/h6,8-13,17,19H,4-5,7H2,1-3H3.
What are the key properties of N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine?
N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine has a molecular weight of 284.40 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-3-pyridinyl)-(4-propylphenyl)methyl]ethanamine is sourced from PubChem (CID 115605108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).