N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine

C11H18N2O — CID 62290830

IUPACN-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine
SMILESCCOc1ncccc1CNC(C)C
InChIInChI=1S/C11H18N2O/c1-4-14-11-10(6-5-7-12-11)8-13-9(2)3/h5-7,9,13H,4,8H2,1-3H3
InChIKeyKNJKUTQMDLAQEX-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.98
Rot. Bonds5

About N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine

N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine (PubChem CID 62290830) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine
PubChem CID62290830
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine
SMILESCCOc1ncccc1CNC(C)C
InChIInChI=1S/C11H18N2O/c1-4-14-11-10(6-5-7-12-11)8-13-9(2)3/h5-7,9,13H,4,8H2,1-3H3
InChIKeyKNJKUTQMDLAQEX-UHFFFAOYSA-N
XLogP1.98
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 ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(2-methylpropoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62289954
N-[[2-(4-ethoxyphenoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62297086
N-[[2-(2-ethoxyphenoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62296049
N-[[2-(2-methylpentoxy)-3-pyridinyl]methyl]propan-2-amine
CID 103285396
N-[[2-(3-methoxypropoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62288607
N-[[2-[(2-bromophenyl)methoxy]-3-pyridinyl]methyl]propan-2-amine
CID 82831234
N-[(2-cyclobutyloxy-3-pyridinyl)methyl]propan-2-amine
CID 62287341
N-[(2-ethoxy-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62290832
N-[(2-ethoxy-3-fluoro-4-pyridinyl)methyl]propan-2-amine
CID 105390794
(1S)-N-[(2-ethoxy-3-pyridinyl)methyl]-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]ethanamine
CID 97308672
N-[[2-(2-methylsulfanylphenoxy)-3-pyridinyl]methyl]propan-2-amine
CID 63648734
N-[[2-(2,3,6-trimethylphenoxy)-3-pyridinyl]methyl]propan-2-amine
CID 62322927

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine?
The IUPAC name of N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine (CID 62290830) is N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine.
What is the SMILES notation for N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine?
The canonical SMILES for N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine is CCOc1ncccc1CNC(C)C.
What is the InChIKey of N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine?
The InChIKey is KNJKUTQMDLAQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-4-14-11-10(6-5-7-12-11)8-13-9(2)3/h5-7,9,13H,4,8H2,1-3H3.
What are the key properties of N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine?
N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine has a molecular weight of 194.28 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxy-3-pyridinyl)methyl]propan-2-amine is sourced from PubChem (CID 62290830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).