N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine

C11H15N5 — CID 115530544

IUPACN-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine
SMILESCNC(c1ccnc(C)n1)c1nccn1C
InChIInChI=1S/C11H15N5/c1-8-13-5-4-9(15-8)10(12-2)11-14-6-7-16(11)3/h4-7,10,12H,1-3H3
InChIKeyPSDRBIFQQRSJOS-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.83
Rot. Bonds3

About N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine

N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine (PubChem CID 115530544) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine
PubChem CID115530544
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC NameN-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine
SMILESCNC(c1ccnc(C)n1)c1nccn1C
InChIInChI=1S/C11H15N5/c1-8-13-5-4-9(15-8)10(12-2)11-14-6-7-16(11)3/h4-7,10,12H,1-3H3
InChIKeyPSDRBIFQQRSJOS-UHFFFAOYSA-N
XLogP0.83
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(1-methylimidazol-2-yl)-1-(2,4,6-trimethylphenyl)methanamine
CID 61315934
1-(2,5-dimethylphenyl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
CID 61316310
N-methyl-1-(1-methylimidazol-2-yl)-1-(2,3,4,5,6-pentafluorophenyl)methanamine
CID 61314637
1-(2-chloro-4-methylphenyl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
CID 106857664
1-(2,5-dimethylpyrazol-3-yl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
CID 105149645
bis(1-methylimidazol-2-yl)methylhydrazine
CID 105258117
1-(3-methoxy-4-methylphenyl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
CID 61316123
N-ethyl-2-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 113329611
1-(3-fluoro-4-pyridinyl)-N-methyl-1-(2-methylpyrimidin-4-yl)methanamine
CID 104738640
1-(3-chlorothiophen-2-yl)-N-methyl-1-(2-methylpyrimidin-4-yl)methanamine
CID 107360093
1-(2,4-dibromophenyl)-N-methyl-1-(1-methylimidazol-2-yl)methanamine
CID 107945877
N-methyl-1-(2-methylpyrimidin-4-yl)-1-(3-phenyltriazol-4-yl)methanamine
CID 114688914

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine?
The IUPAC name of N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine (CID 115530544) is N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine is CNC(c1ccnc(C)n1)c1nccn1C.
What is the InChIKey of N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine?
The InChIKey is PSDRBIFQQRSJOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-8-13-5-4-9(15-8)10(12-2)11-14-6-7-16(11)3/h4-7,10,12H,1-3H3.
What are the key properties of N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine?
N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine has a molecular weight of 217.28 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)methanamine is sourced from PubChem (CID 115530544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).