N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine

C11H16N2O — CID 79782890

IUPACN-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine
SMILESCCOc1ccc(CNC2CC2)nc1
InChIInChI=1S/C11H16N2O/c1-2-14-11-6-5-10(13-8-11)7-12-9-3-4-9/h5-6,8-9,12H,2-4,7H2,1H3
InChIKeyUXPOEEKBFMOBDY-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.73
Rot. Bonds5

About N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine

N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine (PubChem CID 79782890) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine
PubChem CID79782890
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine
SMILESCCOc1ccc(CNC2CC2)nc1
InChIInChI=1S/C11H16N2O/c1-2-14-11-6-5-10(13-8-11)7-12-9-3-4-9/h5-6,8-9,12H,2-4,7H2,1H3
InChIKeyUXPOEEKBFMOBDY-UHFFFAOYSA-N
XLogP1.73
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-(2-methylprop-2-enoxy)-2-pyridinyl]methyl]cyclopropanamine
CID 79783844
2-[[6-[(cyclopropylamino)methyl]-3-pyridinyl]oxy]acetamide
CID 79784048
N-[[5-(3-methylsulfonylpropoxy)-2-pyridinyl]methyl]cyclopropanamine
CID 79783246
ethyl 2-[[6-[(cyclopropylamino)methyl]-3-pyridinyl]oxy]propanoate
CID 79783450
2-[2-[[6-[(cyclopropylamino)methyl]-3-pyridinyl]oxy]ethoxy]ethanol
CID 79781914
N-[[5-(1,3-thiazol-4-ylmethoxy)-2-pyridinyl]methyl]cyclopropanamine
CID 79781522
3-[[6-[(cyclopropylamino)methyl]-3-pyridinyl]oxy]-N-methylpropanamide
CID 79781169
ethyl 2-[[6-[(cyclopropylamino)methyl]-3-pyridinyl]oxy]butanoate
CID 79781152
N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine
CID 79775704
N-[(5-methyl-2-pyridinyl)methyl]cyclopropanamine
CID 80708604
N-[[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]methyl]cyclopropanamine
CID 105402634
N-[[4-(4-ethoxyphenoxy)-2-pyridinyl]methyl]cyclopropanamine
CID 62297962

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine?
The IUPAC name of N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine (CID 79782890) is N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine?
The canonical SMILES for N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine is CCOc1ccc(CNC2CC2)nc1.
What is the InChIKey of N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine?
The InChIKey is UXPOEEKBFMOBDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-14-11-6-5-10(13-8-11)7-12-9-3-4-9/h5-6,8-9,12H,2-4,7H2,1H3.
What are the key properties of N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine?
N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine has a molecular weight of 192.26 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine is sourced from PubChem (CID 79782890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).