2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine

C18H21FN2O — CID 144795559

IUPAC2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine
SMILESCOc1ccc(C(CN)C2CC2)nc1-c1ccc(F)c(C)c1
InChIInChI=1S/C18H21FN2O/c1-11-9-13(5-6-15(11)19)18-17(22-2)8-7-16(21-18)14(10-20)12-3-4-12/h5-9,12,14H,3-4,10,20H2,1-2H3
InChIKeyZEFAAEIXQJZVCX-UHFFFAOYSA-N
MW300.38 g/mol
LogP3.66
Rot. Bonds5

About 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine

2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine (PubChem CID 144795559) has the molecular formula C18H21FN2O and a molecular weight of 300.38 g/mol. Its IUPAC name is 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine
PubChem CID144795559
Molecular FormulaC18H21FN2O
Molecular Weight300.38 g/mol
Exact Mass300.16
IUPAC Name2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine
SMILESCOc1ccc(C(CN)C2CC2)nc1-c1ccc(F)c(C)c1
InChIInChI=1S/C18H21FN2O/c1-11-9-13(5-6-15(11)19)18-17(22-2)8-7-16(21-18)14(10-20)12-3-4-12/h5-9,12,14H,3-4,10,20H2,1-2H3
InChIKeyZEFAAEIXQJZVCX-UHFFFAOYSA-N
XLogP3.66
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine with MolForge

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Related Compounds

2-(2-Fluorophenyl)-5-[(5-methoxy-3-pyridinyl)methyl]pyridine
CID 145981780
N-((6-(4-fluoro-2-methoxyphenyl)pyridin-2-yl)methyl)cyclopentanamine
CID 54581904
US9676701, 38 (trans)-2-(6-(4-fluoro-3-methoxyphenyl)pyridin-3-yl)cyclopropanamine hydrochloride
CID 56653675
US9676701, 40 (trans)-2-(6-(2-fluoro-5-methoxyphenyl)pyridin-3-yl)cyclopropanamine hydrochloride
CID 56653676
US9676701, 41 (trans)-2-(6-(2-fluoro-3-methoxyphenyl)pyridin-3-yl)cyclopropanamine hydrochloride
CID 56653677
US9676701, 44 (trans)-2-(6-(3-methoxy-5-(trifluoromethyl)phenyl)pyridin-3-yl)cyclopropanamine hydrochloride
CID 56654020
US9676701, 58 (Trans)-2-(6-(3,4-difluoro-5-methoxyphenyl)pyridin-3-yl)cyclopropanamine hydrochloride
CID 56654365
(1S)-N-[(5-methoxy-3-pyridinyl)methyl]-2-phenylcyclopropan-1-amine
CID 58035527
(2R)-2-[[6-(3,4-difluoro-5-methoxyphenyl)-3-fluoro-2-pyridinyl]methylamino]-3-methylbutan-1-ol
CID 68312869
US9676701, 39 (trans)-2-(6-(3-fluoro-5-methoxyphenyl)pyridin-3-yl)cyclopropanamine hydrochloride
CID 69912397
(1S)-N-[(6-methoxy-2-pyridinyl)methyl]-2-phenylcyclopropan-1-amine
CID 91970493
US10155760, Example 149
CID 118420636

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine?
The IUPAC name of 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine (CID 144795559) is 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine.
What is the SMILES notation for 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine?
The canonical SMILES for 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine is COc1ccc(C(CN)C2CC2)nc1-c1ccc(F)c(C)c1.
What is the InChIKey of 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine?
The InChIKey is ZEFAAEIXQJZVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O/c1-11-9-13(5-6-15(11)19)18-17(22-2)8-7-16(21-18)14(10-20)12-3-4-12/h5-9,12,14H,3-4,10,20H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine?
2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine has a molecular weight of 300.38 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]ethanamine is sourced from PubChem (CID 144795559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).