2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine

C15H25N3O — CID 106906913

IUPAC2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine
SMILESCNCc1cccc(CN(C)CCOCC2CC2)n1
InChIInChI=1S/C15H25N3O/c1-16-10-14-4-3-5-15(17-14)11-18(2)8-9-19-12-13-6-7-13/h3-5,13,16H,6-12H2,1-2H3
InChIKeyNRQUOVDCMCCMTH-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.66
Rot. Bonds9

About 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine

2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine (PubChem CID 106906913) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine
PubChem CID106906913
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine
SMILESCNCc1cccc(CN(C)CCOCC2CC2)n1
InChIInChI=1S/C15H25N3O/c1-16-10-14-4-3-5-15(17-14)11-18(2)8-9-19-12-13-6-7-13/h3-5,13,16H,6-12H2,1-2H3
InChIKeyNRQUOVDCMCCMTH-UHFFFAOYSA-N
XLogP1.66
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-cyclohexyl-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]methanamine
CID 106905342
N-[[6-[[3-methoxypropyl(methyl)amino]methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106906493
N-[[6-[[cyclopropylmethyl(methyl)amino]methyl]-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106905994
1-(1-ethylpyrrolidin-2-yl)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]methanamine
CID 106906839
1-[6-[[(3-chlorophenyl)methyl-methylamino]methyl]-2-pyridinyl]-N-methylmethanamine
CID 106906091
2-(cyclopropylmethoxy)-N-[(2-hydrazinyl-3-nitrophenyl)methyl]-N-methylethanamine
CID 107353100
1-[6-(fluoromethyl)-2-pyridinyl]-N-methylmethanamine
CID 84763498
N-ethyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-1-amine
CID 106905733
4-methoxy-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]aniline
CID 106906232
6-[[2-ethoxyethyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 81073763
1-methoxy-N-(2-methoxyethyl)-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-2-amine
CID 106906404
3-[[2-(cyclopropylmethoxy)ethyl-methylamino]methyl]-2-fluorobenzenecarboximidamide
CID 107117984

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine?
The IUPAC name of 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine (CID 106906913) is 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine is CNCc1cccc(CN(C)CCOCC2CC2)n1.
What is the InChIKey of 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine?
The InChIKey is NRQUOVDCMCCMTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-16-10-14-4-3-5-15(17-14)11-18(2)8-9-19-12-13-6-7-13/h3-5,13,16H,6-12H2,1-2H3.
What are the key properties of 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine?
2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine has a molecular weight of 263.38 g/mol, XLogP of 1.66, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 106906913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).