5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine

C15H18FN3O — CID 171849956

IUPAC5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine
SMILESCCCNc1ncc(F)cc1-c1ccc(OC)nc1C
InChIInChI=1S/C15H18FN3O/c1-4-7-17-15-13(8-11(16)9-18-15)12-5-6-14(20-3)19-10(12)2/h5-6,8-9H,4,7H2,1-3H3,(H,17,18)
InChIKeyXDDSFTASYVHFOH-UHFFFAOYSA-N
MW275.33 g/mol
LogP3.42
Rot. Bonds5

About 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine

5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine (PubChem CID 171849956) has the molecular formula C15H18FN3O and a molecular weight of 275.33 g/mol. Its IUPAC name is 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine
PubChem CID171849956
Molecular FormulaC15H18FN3O
Molecular Weight275.33 g/mol
Exact Mass275.14
IUPAC Name5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine
SMILESCCCNc1ncc(F)cc1-c1ccc(OC)nc1C
InChIInChI=1S/C15H18FN3O/c1-4-7-17-15-13(8-11(16)9-18-15)12-5-6-14(20-3)19-10(12)2/h5-6,8-9H,4,7H2,1-3H3,(H,17,18)
InChIKeyXDDSFTASYVHFOH-UHFFFAOYSA-N
XLogP3.42
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 6-[4-[5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-2-pyridinyl]piperazin-1-yl]-2-azaspiro[3.4]octane-2-carboxylate
CID 175631729
3,5-difluoro-2-[6-methoxy-2-(methoxymethoxymethyl)-3-pyridinyl]pyridine
CID 129114740
2-(4-chloro-2-methoxyphenyl)-5-fluoro-6-methyl-N-propylpyrimidin-4-amine
CID 106819704
N-[5-fluoro-2-(propylamino)-3-pyridinyl]formamide
CID 135192100
2-(5-fluoro-2-methylphenyl)-5-iodo-6-methyl-N-propylpyrimidin-4-amine
CID 66305737
2-(6-methoxypyrimidin-4-yl)-5,6-dimethyl-N-propylpyrimidin-4-amine
CID 102952705
5-bromo-2-(4-chloro-2-methoxyphenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 106819708
4-(2-chloro-5-fluorophenyl)-5-methyl-N-propylpyrimidin-2-amine
CID 105396175
2-(5-fluoro-2-pyridinyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 79713717
5-fluoro-4-(2-fluoro-4-methoxyphenyl)-N-propylpyrimidin-2-amine
CID 115505267
6-fluoro-2-methoxyindeno[2,3-b]pyridin-9-one
CID 155039769
2-N-butyl-6-methoxypyridine-2,3-diamine
CID 115320288

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine?
The IUPAC name of 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine (CID 171849956) is 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine.
What is the SMILES notation for 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine?
The canonical SMILES for 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine is CCCNc1ncc(F)cc1-c1ccc(OC)nc1C.
What is the InChIKey of 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine?
The InChIKey is XDDSFTASYVHFOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O/c1-4-7-17-15-13(8-11(16)9-18-15)12-5-6-14(20-3)19-10(12)2/h5-6,8-9H,4,7H2,1-3H3,(H,17,18).
What are the key properties of 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine?
5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine has a molecular weight of 275.33 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-(6-methoxy-2-methyl-3-pyridinyl)-N-propylpyridin-2-amine is sourced from PubChem (CID 171849956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).