N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine

C12H15N5 — CID 55114618

IUPACN-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine
SMILESCCNCc1cc(C)nc(-c2ncccn2)n1
InChIInChI=1S/C12H15N5/c1-3-13-8-10-7-9(2)16-12(17-10)11-14-5-4-6-15-11/h4-7,13H,3,8H2,1-2H3
InChIKeyMZMFNHGEJQPLTB-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.35
Rot. Bonds4

About N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine

N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine (PubChem CID 55114618) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine
PubChem CID55114618
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC NameN-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine
SMILESCCNCc1cc(C)nc(-c2ncccn2)n1
InChIInChI=1S/C12H15N5/c1-3-13-8-10-7-9(2)16-12(17-10)11-14-5-4-6-15-11/h4-7,13H,3,8H2,1-2H3
InChIKeyMZMFNHGEJQPLTB-UHFFFAOYSA-N
XLogP1.35
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]cyclopropanamine
CID 62746577
N-[[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]methyl]ethanamine
CID 62744634
4-[4-(ethylaminomethyl)-6-methylpyrimidin-2-yl]phenol
CID 136889379
N-[[2-(furan-2-yl)-6-methylpyrimidin-4-yl]methyl]ethanamine
CID 62746211
N-[[6-methyl-2-(2-methylfuran-3-yl)pyrimidin-4-yl]methyl]ethanamine
CID 104790819
N-[[2-(3,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]methyl]ethanamine
CID 62744975
N-[[2-(3-ethyl-2-pyridinyl)-6-methylpyrimidin-4-yl]methyl]propan-1-amine
CID 82740701
N-[(6-methyl-2-phenylpyrimidin-4-yl)methyl]propan-1-amine
CID 62745336
2-methoxy-N-[(6-methyl-2-pyridin-2-ylpyrimidin-4-yl)methyl]ethanamine
CID 62744312
N-[(6-methyl-2-pyridin-3-ylpyrimidin-4-yl)methyl]propan-1-amine
CID 62744815
N-[[6-methyl-2-(methylsulfonylmethyl)pyrimidin-4-yl]methyl]ethanamine
CID 62746741
N-[[2-(3-bromo-4-methylphenyl)pyrimidin-4-yl]methyl]ethanamine
CID 114015473

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine?
The IUPAC name of N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine (CID 55114618) is N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine.
What is the SMILES notation for N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine?
The canonical SMILES for N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine is CCNCc1cc(C)nc(-c2ncccn2)n1.
What is the InChIKey of N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine?
The InChIKey is MZMFNHGEJQPLTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-3-13-8-10-7-9(2)16-12(17-10)11-14-5-4-6-15-11/h4-7,13H,3,8H2,1-2H3.
What are the key properties of N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine?
N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine has a molecular weight of 229.29 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]ethanamine is sourced from PubChem (CID 55114618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).