N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine

C14H22N2O — CID 83044254

IUPACN-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine
SMILESCCCC(CNC1CC1)Oc1ccc(C)nc1
InChIInChI=1S/C14H22N2O/c1-3-4-13(10-16-12-6-7-12)17-14-8-5-11(2)15-9-14/h5,8-9,12-13,16H,3-4,6-7,10H2,1-2H3
InChIKeyQDRMZPGDAIYGPZ-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.69
Rot. Bonds7

About N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine

N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine (PubChem CID 83044254) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine
PubChem CID83044254
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine
SMILESCCCC(CNC1CC1)Oc1ccc(C)nc1
InChIInChI=1S/C14H22N2O/c1-3-4-13(10-16-12-6-7-12)17-14-8-5-11(2)15-9-14/h5,8-9,12-13,16H,3-4,6-7,10H2,1-2H3
InChIKeyQDRMZPGDAIYGPZ-UHFFFAOYSA-N
XLogP2.69
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-quinolin-3-yloxypentyl)cyclopropanamine
CID 107387783
N-[2-[4-(trifluoromethyl)phenoxy]pentyl]cyclopropanamine
CID 83044258
N-[2-(1-methylpyrazol-4-yl)oxypentyl]cyclopropanamine
CID 116793651
N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pentyl]cyclopropanamine
CID 83044892
N-[2-(4-chloro-3-ethylphenoxy)pentyl]cyclopropanamine
CID 83044546
N-[2-(3-fluorophenoxy)pentyl]cyclopropanamine
CID 83043805
N-(2-quinolin-5-yloxypentyl)cyclopropanamine
CID 103045789
N-[2-(5-bromo-2-methylphenoxy)pentyl]cyclopropanamine
CID 107285996
N-[2-(5-chloro-2-methylphenoxy)pentyl]cyclopropanamine
CID 83045481
N-[2-(2,3,5-trimethylphenoxy)pentyl]cyclopropanamine
CID 83044881
N-[2-(4-chlorophenoxy)butyl]cyclopropanamine
CID 62454944
N-[2-methyl-3-(6-methyl-3-pyridinyl)propyl]cyclopropanamine
CID 64666694

Frequently Asked Questions

What is the IUPAC name of N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine?
The IUPAC name of N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine (CID 83044254) is N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine.
What is the SMILES notation for N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine?
The canonical SMILES for N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine is CCCC(CNC1CC1)Oc1ccc(C)nc1.
What is the InChIKey of N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine?
The InChIKey is QDRMZPGDAIYGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-3-4-13(10-16-12-6-7-12)17-14-8-5-11(2)15-9-14/h5,8-9,12-13,16H,3-4,6-7,10H2,1-2H3.
What are the key properties of N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine?
N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine has a molecular weight of 234.34 g/mol, XLogP of 2.69, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(6-methyl-3-pyridinyl)oxy]pentyl]cyclopropanamine is sourced from PubChem (CID 83044254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).