N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine

C15H16N6 — CID 119036366

IUPACN-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine
SMILESCc1cc(NC(C)c2ncc[nH]2)nc(-c2ccncc2)n1
InChIInChI=1S/C15H16N6/c1-10-9-13(20-11(2)14-17-7-8-18-14)21-15(19-10)12-3-5-16-6-4-12/h3-9,11H,1-2H3,(H,17,18)(H,19,20,21)
InChIKeyMIRYUPVUPBDILN-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.74
Rot. Bonds4

About N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine

N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine (PubChem CID 119036366) has the molecular formula C15H16N6 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine
PubChem CID119036366
Molecular FormulaC15H16N6
Molecular Weight280.33 g/mol
Exact Mass280.14
IUPAC NameN-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine
SMILESCc1cc(NC(C)c2ncc[nH]2)nc(-c2ccncc2)n1
InChIInChI=1S/C15H16N6/c1-10-9-13(20-11(2)14-17-7-8-18-14)21-15(19-10)12-3-5-16-6-4-12/h3-9,11H,1-2H3,(H,17,18)(H,19,20,21)
InChIKeyMIRYUPVUPBDILN-UHFFFAOYSA-N
XLogP2.74
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Glu-P 1
CID 49971
Mifentidine
CID 71263
SB-220025
CID 5164
6-(4-((4-Ethyl-1-piperazinyl)methyl)phenyl)-N-((1R)-1-phenylethyl)-7H-pyrrolo(2,3-d)pyrimidin-4-amine
CID 10297043
2-(pyridin-3-yl)-1H-1,3-benzodiazole
CID 247635
PF-4708671
CID 51371303
2-((4-pyridin-2-ylpiperazine-1-yl)methyl)-1H-benzimidazole
CID 5025739
3-(1H-imidazol-5-yl)pyridine
CID 3040177
Rolodine
CID 5359646
Immethridine
CID 9989505
5H-Pyrrolo(3,2-d)pyrimidin-4-amine
CID 5287565
2-(pyridin-4-yl)-1H-1,3-benzodiazole
CID 247634

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine?
The IUPAC name of N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine (CID 119036366) is N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine is Cc1cc(NC(C)c2ncc[nH]2)nc(-c2ccncc2)n1.
What is the InChIKey of N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine?
The InChIKey is MIRYUPVUPBDILN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6/c1-10-9-13(20-11(2)14-17-7-8-18-14)21-15(19-10)12-3-5-16-6-4-12/h3-9,11H,1-2H3,(H,17,18)(H,19,20,21).
What are the key properties of N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine?
N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine has a molecular weight of 280.33 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-imidazol-2-yl)ethyl]-6-methyl-2-pyridin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 119036366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).