2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine

C16H18N6 — CID 167795619

IUPAC2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine
SMILESCc1cc(NCc2ccnc(-n3ccnc3C)c2)nc(C)n1
InChIInChI=1S/C16H18N6/c1-11-8-15(21-12(2)20-11)19-10-14-4-5-18-16(9-14)22-7-6-17-13(22)3/h4-9H,10H2,1-3H3,(H,19,20,21)
InChIKeyYDYKUVBXWCZYAH-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.59
Rot. Bonds4

About 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine

2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine (PubChem CID 167795619) has the molecular formula C16H18N6 and a molecular weight of 294.36 g/mol. Its IUPAC name is 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine
PubChem CID167795619
Molecular FormulaC16H18N6
Molecular Weight294.36 g/mol
Exact Mass294.16
IUPAC Name2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine
SMILESCc1cc(NCc2ccnc(-n3ccnc3C)c2)nc(C)n1
InChIInChI=1S/C16H18N6/c1-11-8-15(21-12(2)20-11)19-10-14-4-5-18-16(9-14)22-7-6-17-13(22)3/h4-9H,10H2,1-3H3,(H,19,20,21)
InChIKeyYDYKUVBXWCZYAH-UHFFFAOYSA-N
XLogP2.59
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine?
The IUPAC name of 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine (CID 167795619) is 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine.
What is the SMILES notation for 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine?
The canonical SMILES for 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine is Cc1cc(NCc2ccnc(-n3ccnc3C)c2)nc(C)n1.
What is the InChIKey of 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine?
The InChIKey is YDYKUVBXWCZYAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6/c1-11-8-15(21-12(2)20-11)19-10-14-4-5-18-16(9-14)22-7-6-17-13(22)3/h4-9H,10H2,1-3H3,(H,19,20,21).
What are the key properties of 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine?
2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine has a molecular weight of 294.36 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-[[2-(2-methylimidazol-1-yl)-4-pyridinyl]methyl]pyrimidin-4-amine is sourced from PubChem (CID 167795619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).