(3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine

C16H18N2O2 — CID 105066137

IUPAC(3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine
SMILESCOc1cnccc1C(N)c1cccc(OC2CC2)c1
InChIInChI=1S/C16H18N2O2/c1-19-15-10-18-8-7-14(15)16(17)11-3-2-4-13(9-11)20-12-5-6-12/h2-4,7-10,12,16H,5-6,17H2,1H3
InChIKeyMAULXECALQYXAM-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.68
Rot. Bonds5

About (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine

(3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine (PubChem CID 105066137) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine.

Molecular Properties

Compound Name(3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine
PubChem CID105066137
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name(3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine
SMILESCOc1cnccc1C(N)c1cccc(OC2CC2)c1
InChIInChI=1S/C16H18N2O2/c1-19-15-10-18-8-7-14(15)16(17)11-3-2-4-13(9-11)20-12-5-6-12/h2-4,7-10,12,16H,5-6,17H2,1H3
InChIKeyMAULXECALQYXAM-UHFFFAOYSA-N
XLogP2.68
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-cyclopropyloxyphenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
CID 105066138
(3-methoxy-4-pyridinyl)-pyrimidin-5-ylmethanamine
CID 105065336
(3-chloro-4-pyridinyl)-(3-methoxyphenyl)methanamine
CID 105086338
1-(3-cyclopropyloxyphenyl)-1-(3-fluoro-4-pyridinyl)-N-methylmethanamine
CID 114522070
(2-amino-3-methoxyphenyl)-(3-cyclopropyloxyphenyl)methanol
CID 107469550
(2,3-dichlorophenyl)-(3-methoxy-4-pyridinyl)methanamine
CID 105065497
(3-cyclopropyloxyphenyl)-(3,5-difluorophenyl)methanamine
CID 114521611
2-cyclopropyl-1-(3-cyclopropyloxyphenyl)propan-1-amine
CID 105051847
(3-cyclopropyloxyphenyl)-(3-fluoro-2-pyridinyl)methanamine
CID 114522053
(3-cyclopropyloxyphenyl)-(3,4-difluorophenyl)methanamine
CID 114521500
(3-cyclopropyloxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanamine
CID 105051741
isoquinolin-5-yl-(3-methoxyphenyl)methanamine
CID 62813526

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine?
The IUPAC name of (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine (CID 105066137) is (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine.
What is the SMILES notation for (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine?
The canonical SMILES for (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine is COc1cnccc1C(N)c1cccc(OC2CC2)c1.
What is the InChIKey of (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine?
The InChIKey is MAULXECALQYXAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-19-15-10-18-8-7-14(15)16(17)11-3-2-4-13(9-11)20-12-5-6-12/h2-4,7-10,12,16H,5-6,17H2,1H3.
What are the key properties of (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine?
(3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine has a molecular weight of 270.33 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyloxyphenyl)-(3-methoxy-4-pyridinyl)methanamine is sourced from PubChem (CID 105066137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).