N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine

C11H18N2O — CID 79775957

IUPACN-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine
SMILESCNCc1ccc(OCC(C)C)cn1
InChIInChI=1S/C11H18N2O/c1-9(2)8-14-11-5-4-10(6-12-3)13-7-11/h4-5,7,9,12H,6,8H2,1-3H3
InChIKeyPKUYDQVUMAXQBK-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.84
Rot. Bonds5

About N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine

N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine (PubChem CID 79775957) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine
PubChem CID79775957
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine
SMILESCNCc1ccc(OCC(C)C)cn1
InChIInChI=1S/C11H18N2O/c1-9(2)8-14-11-5-4-10(6-12-3)13-7-11/h4-5,7,9,12H,6,8H2,1-3H3
InChIKeyPKUYDQVUMAXQBK-UHFFFAOYSA-N
XLogP1.84
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(2-methylpropoxy)-2-pyridinyl]methanamine
CID 79787202
2-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
CID 79799793
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
CID 83127836
N-methyl-1-(5-prop-2-ynoxy-2-pyridinyl)methanamine
CID 79776395
2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]propanoic acid
CID 79776211
N-[[5-(2,2-difluoroethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79782331
1-(2-methoxyethoxy)-3-[[6-(methylaminomethyl)-3-pyridinyl]oxy]propan-2-ol
CID 106988796
1-(5-but-3-enoxy-2-pyridinyl)-N-methylmethanamine
CID 79775770
N-[[5-(2-methylpentoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79781493
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]propan-1-amine
CID 112584711
1-[5-[(4-bromophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 79775958
1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 105402628

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine (CID 79775957) is N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine is CNCc1ccc(OCC(C)C)cn1.
What is the InChIKey of N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine?
The InChIKey is PKUYDQVUMAXQBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9(2)8-14-11-5-4-10(6-12-3)13-7-11/h4-5,7,9,12H,6,8H2,1-3H3.
What are the key properties of N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine?
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine has a molecular weight of 194.28 g/mol, XLogP of 1.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 79775957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).