N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine

C16H13FN4 — CID 171680422

IUPACN-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine
SMILESFc1ccc(CNc2cccc(-c3cccnc3)n2)nc1
InChIInChI=1S/C16H13FN4/c17-13-6-7-14(19-10-13)11-20-16-5-1-4-15(21-16)12-3-2-8-18-9-12/h1-10H,11H2,(H,20,21)
InChIKeyNMEPDYXIPLHREG-UHFFFAOYSA-N
MW280.31 g/mol
LogP3.29
Rot. Bonds4

About N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine

N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine (PubChem CID 171680422) has the molecular formula C16H13FN4 and a molecular weight of 280.31 g/mol. Its IUPAC name is N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine.

Molecular Properties

Compound NameN-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine
PubChem CID171680422
Molecular FormulaC16H13FN4
Molecular Weight280.31 g/mol
Exact Mass280.11
IUPAC NameN-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine
SMILESFc1ccc(CNc2cccc(-c3cccnc3)n2)nc1
InChIInChI=1S/C16H13FN4/c17-13-6-7-14(19-10-13)11-20-16-5-1-4-15(21-16)12-3-2-8-18-9-12/h1-10H,11H2,(H,20,21)
InChIKeyNMEPDYXIPLHREG-UHFFFAOYSA-N
XLogP3.29
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.31
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-pyridin-3-yl-N-[[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]-2-pyridinyl]methyl]pyridin-2-amine
CID 71569459
2,6-dipyridin-3-ylpyridine
CID 13349632
2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 69182655
N-(6-pyridin-3-yl-2-pyridinyl)-1,3-thiazol-2-amine
CID 169101788
2-[3,5-bis[6-[6-(6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]phenyl]-6-[6-(6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyridine
CID 58090487
2-methyl-6-pyridin-3-ylpyridine;propane
CID 144615785
2-(6-pyridin-3-yl-2-pyridinyl)acetic acid
CID 46316923
2-(6-pyridin-3-yl-2-pyridinyl)acetonitrile
CID 71732783
7-fluoro-3-pyridin-3-ylisoquinoline
CID 25058388
ethane;2-methyl-6-pyridin-3-ylpyridine
CID 144687863
N,N',N'-tris[(6-pyridin-2-yl-2-pyridinyl)methyl]-N-[(6-pyridin-3-yl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 59780170
N-[(4-methylphenyl)methyl]-2-pyridin-3-ylpyrimidin-4-amine
CID 44820593

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine?
The IUPAC name of N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine (CID 171680422) is N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine.
What is the SMILES notation for N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine?
The canonical SMILES for N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine is Fc1ccc(CNc2cccc(-c3cccnc3)n2)nc1.
What is the InChIKey of N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine?
The InChIKey is NMEPDYXIPLHREG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN4/c17-13-6-7-14(19-10-13)11-20-16-5-1-4-15(21-16)12-3-2-8-18-9-12/h1-10H,11H2,(H,20,21).
What are the key properties of N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine?
N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine has a molecular weight of 280.31 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-2-pyridinyl)methyl]-6-pyridin-3-ylpyridin-2-amine is sourced from PubChem (CID 171680422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).