N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine

C17H20N2O2 — CID 62291856

IUPACN-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine
SMILESCOc1ccc(COc2cc(CNC3CC3)ccn2)cc1
InChIInChI=1S/C17H20N2O2/c1-20-16-6-2-13(3-7-16)12-21-17-10-14(8-9-18-17)11-19-15-4-5-15/h2-3,6-10,15,19H,4-5,11-12H2,1H3
InChIKeyINHNRFFQHCNFOA-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.92
Rot. Bonds7

About N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine

N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine (PubChem CID 62291856) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine
PubChem CID62291856
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine
SMILESCOc1ccc(COc2cc(CNC3CC3)ccn2)cc1
InChIInChI=1S/C17H20N2O2/c1-20-16-6-2-13(3-7-16)12-21-17-10-14(8-9-18-17)11-19-15-4-5-15/h2-3,6-10,15,19H,4-5,11-12H2,1H3
InChIKeyINHNRFFQHCNFOA-UHFFFAOYSA-N
XLogP2.92
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(3,4-dimethylphenoxy)-4-pyridinyl]methyl]cyclopropanamine
CID 62296267
N-[[3-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methyl]cyclopropanamine
CID 43275383
N-[[2-[3-(dimethylamino)propoxy]-4-pyridinyl]methyl]cyclopropanamine
CID 55058266
N-[(4-methoxyphenyl)methyl]cycloheptanamine
CID 784052
N-[(2-methoxy-4-pyridinyl)methyl]azepan-4-amine
CID 113361573
3-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]cyclobutan-1-amine
CID 104871414
5-[(cyclopropylamino)methyl]-N-[(2-methoxy-4-pyridinyl)methyl]-1,3,4-oxadiazol-2-amine
CID 106960831
N-[(2-methoxy-4-pyridinyl)methyl]-1,2-dimethylpiperidin-4-amine
CID 81297222
N-[(4-methoxyphenyl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62702803
4-ethyl-N-[(4-methoxyphenyl)methyl]cyclohexan-1-amine
CID 782105
N-[[4-[(4-methylphenoxy)methyl]phenyl]methyl]cyclopropanamine
CID 62450351
2-methoxy-4-[(4-methoxyphenyl)methoxy]pyridine
CID 70697685

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine (CID 62291856) is N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine is COc1ccc(COc2cc(CNC3CC3)ccn2)cc1.
What is the InChIKey of N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine?
The InChIKey is INHNRFFQHCNFOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-20-16-6-2-13(3-7-16)12-21-17-10-14(8-9-18-17)11-19-15-4-5-15/h2-3,6-10,15,19H,4-5,11-12H2,1H3.
What are the key properties of N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine?
N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine has a molecular weight of 284.36 g/mol, XLogP of 2.92, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(4-methoxyphenyl)methoxy]-4-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 62291856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).