N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine

C15H14N4 — CID 50961103

IUPACN-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine
SMILESCNc1ncccc1-c1[nH]cnc1-c1ccccc1
InChIInChI=1S/C15H14N4/c1-16-15-12(8-5-9-17-15)14-13(18-10-19-14)11-6-3-2-4-7-11/h2-10H,1H3,(H,16,17)(H,18,19)
InChIKeyHIZLMCRQBWLYOT-UHFFFAOYSA-N
MW250.31 g/mol
LogP3.18
Rot. Bonds3

About N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine

N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine (PubChem CID 50961103) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine
PubChem CID50961103
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC NameN-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine
SMILESCNc1ncccc1-c1[nH]cnc1-c1ccccc1
InChIInChI=1S/C15H14N4/c1-16-15-12(8-5-9-17-15)14-13(18-10-19-14)11-6-3-2-4-7-11/h2-10H,1H3,(H,16,17)(H,18,19)
InChIKeyHIZLMCRQBWLYOT-UHFFFAOYSA-N
XLogP3.18
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine?
The IUPAC name of N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine (CID 50961103) is N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine.
What is the SMILES notation for N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine?
The canonical SMILES for N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine is CNc1ncccc1-c1[nH]cnc1-c1ccccc1.
What is the InChIKey of N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine?
The InChIKey is HIZLMCRQBWLYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-16-15-12(8-5-9-17-15)14-13(18-10-19-14)11-6-3-2-4-7-11/h2-10H,1H3,(H,16,17)(H,18,19).
What are the key properties of N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine?
N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine has a molecular weight of 250.31 g/mol, XLogP of 3.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(4-phenyl-1H-imidazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 50961103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).