3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine

C15H13FN4 — CID 114717841

IUPAC3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine
SMILESNc1ccncc1-c1cncn1Cc1cccc(F)c1
InChIInChI=1S/C15H13FN4/c16-12-3-1-2-11(6-12)9-20-10-19-8-15(20)13-7-18-5-4-14(13)17/h1-8,10H,9H2,(H2,17,18)
InChIKeyPLGIPVHZSXUIHB-UHFFFAOYSA-N
MW268.30 g/mol
LogP2.71
Rot. Bonds3

About 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine

3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine (PubChem CID 114717841) has the molecular formula C15H13FN4 and a molecular weight of 268.30 g/mol. Its IUPAC name is 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine.

Molecular Properties

Compound Name3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine
PubChem CID114717841
Molecular FormulaC15H13FN4
Molecular Weight268.30 g/mol
Exact Mass268.11
IUPAC Name3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine
SMILESNc1ccncc1-c1cncn1Cc1cccc(F)c1
InChIInChI=1S/C15H13FN4/c16-12-3-1-2-11(6-12)9-20-10-19-8-15(20)13-7-18-5-4-14(13)17/h1-8,10H,9H2,(H2,17,18)
InChIKeyPLGIPVHZSXUIHB-UHFFFAOYSA-N
XLogP2.71
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.30
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-[(4-methylphenyl)methyl]imidazol-4-yl]pyridin-4-amine
CID 114716960
3-[3-(1,2-oxazol-5-ylmethyl)imidazol-4-yl]pyridin-4-amine
CID 106422521
ethane;5-ethyl-1-[(3-fluorophenyl)methyl]imidazole
CID 91389513
3-[3-[(2-chlorophenyl)methyl]imidazol-4-yl]pyridin-4-amine
CID 114716564
3-(3-prop-2-enylimidazol-4-yl)pyridin-4-amine
CID 114717599
3-[3-[(3-methylthiophen-2-yl)methyl]imidazol-4-yl]pyridin-4-amine
CID 114721352
3-amino-1-[(3-fluorophenyl)methyl]pyridin-2-one
CID 62101796
3-[3-[2-(4-chlorophenyl)ethyl]imidazol-4-yl]pyridin-4-amine
CID 114718909
3-[[5-(2-amino-3-pyridinyl)imidazol-1-yl]methyl]benzonitrile
CID 114719737
3-bromo-1-[(3-fluorophenyl)methyl]pyrrolo[2,3-c]pyridine
CID 170986154
1-[(3-fluorophenyl)methyl]-3-pyridin-4-ylpyrazol-4-amine
CID 83222946
3-[3-(4-fluoro-2-methylphenyl)imidazol-4-yl]pyridin-4-amine
CID 114716848

Frequently Asked Questions

What is the IUPAC name of 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine?
The IUPAC name of 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine (CID 114717841) is 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine.
What is the SMILES notation for 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine?
The canonical SMILES for 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine is Nc1ccncc1-c1cncn1Cc1cccc(F)c1.
What is the InChIKey of 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine?
The InChIKey is PLGIPVHZSXUIHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4/c16-12-3-1-2-11(6-12)9-20-10-19-8-15(20)13-7-18-5-4-14(13)17/h1-8,10H,9H2,(H2,17,18).
What are the key properties of 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine?
3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine has a molecular weight of 268.30 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[(3-fluorophenyl)methyl]imidazol-4-yl]pyridin-4-amine is sourced from PubChem (CID 114717841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).