4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine

C19H19FN4 — CID 130450743

IUPAC4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine
SMILESNc1cc(C(Cc2ccccc2)c2ccccc2F)c(N)c(N)n1
InChIInChI=1S/C19H19FN4/c20-16-9-5-4-8-13(16)14(10-12-6-2-1-3-7-12)15-11-17(21)24-19(23)18(15)22/h1-9,11,14H,10,22H2,(H4,21,23,24)
InChIKeySLZFNIHSXUGKRA-UHFFFAOYSA-N
MW322.39 g/mol
LogP3.34
Rot. Bonds4

About 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine

4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine (PubChem CID 130450743) has the molecular formula C19H19FN4 and a molecular weight of 322.39 g/mol. Its IUPAC name is 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine.

Molecular Properties

Compound Name4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine
PubChem CID130450743
Molecular FormulaC19H19FN4
Molecular Weight322.39 g/mol
Exact Mass322.16
IUPAC Name4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine
SMILESNc1cc(C(Cc2ccccc2)c2ccccc2F)c(N)c(N)n1
InChIInChI=1S/C19H19FN4/c20-16-9-5-4-8-13(16)14(10-12-6-2-1-3-7-12)15-11-17(21)24-19(23)18(15)22/h1-9,11,14H,10,22H2,(H4,21,23,24)
InChIKeySLZFNIHSXUGKRA-UHFFFAOYSA-N
XLogP3.34
TPSA90.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 53.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-4,6-diphenylpyridine-3-carbonitrile
CID 668105
4-(4-Methylphenyl)-6-phenylpyridin-2-amine
CID 2113077
N-{(3r,4r)-4-[(6-Amino-4-Methylpyridin-2-Yl)methyl]pyrrolidin-3-Yl}-N'-[2-(3-Fluorophenyl)ethyl]ethane-1,2-Diamine
CID 24764596
N-{(3S,4S)-4-[(6-amino-4-methylpyridin-2-yl)methyl]pyrrolidin-3-yl}-N'-[2-(3-fluorophenyl)ethyl]ethane-1,2-diamine
CID 24798098
N-{(3R,4S)-4-[(6-amino-4-methylpyridin-2-yl)methyl]pyrrolidin-3-yl}-N'-[2-(3-fluorophenyl)ethyl]ethane-1,2-diamine
CID 45259040
N-{(3s,4r)-4-[(6-Amino-4-Methylpyridin-2-Yl)methyl]pyrrolidin-3-Yl}-N'-[2-(3-Fluorophenyl)ethyl]ethane-1,2-Diamine
CID 45259041
NOS Inhibitor, 3h
CID 46892701
6-(2-{3-[2-(2-Amino-6-Methylpyridin-4-Yl)ethyl]phenyl}ethyl)-4-Methylpyridin-2-Amine
CID 46892821
6,6'-[(5-Aminobenzene-1,3-Diyl)diethane-2,1-Diyl]bis(4-Methylpyridin-2-Amine)
CID 49852670
N1-(3-(2-(6-Amino-4-Methylpyridin-2-Yl)ethyl)phenyl)-N1,N2-Dimethylethane-1,2-Diamine
CID 91808024
N1-(3-(2-(6-Amino-4-Methylpyridin-2-Yl)ethyl)-5-Fluorophenyl)-N1,N2-Dimethylethane-1,2-Diamine
CID 91819608
6-(2-{3-[3-(Dimethylamino)propyl]-2,6-difluorophenyl}ethyl)-4-methylpyridin-2-amine
CID 137530115

Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine?
The IUPAC name of 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine (CID 130450743) is 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine.
What is the SMILES notation for 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine?
The canonical SMILES for 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine is Nc1cc(C(Cc2ccccc2)c2ccccc2F)c(N)c(N)n1.
What is the InChIKey of 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine?
The InChIKey is SLZFNIHSXUGKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4/c20-16-9-5-4-8-13(16)14(10-12-6-2-1-3-7-12)15-11-17(21)24-19(23)18(15)22/h1-9,11,14H,10,22H2,(H4,21,23,24).
What are the key properties of 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine?
4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine has a molecular weight of 322.39 g/mol, XLogP of 3.34, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-fluorophenyl)-2-phenylethyl]pyridine-2,3,6-triamine is sourced from PubChem (CID 130450743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).