1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine

C14H18N4 — CID 114245200

IUPAC1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2ncc(C)cc2C)ncc1C
InChIInChI=1S/C14H18N4/c1-9-5-10(2)13(16-6-9)14-17-7-11(3)12(18-14)8-15-4/h5-7,15H,8H2,1-4H3
InChIKeyMFBUACLZIBDVAU-UHFFFAOYSA-N
MW242.33 g/mol
LogP2.18
Rot. Bonds3

About 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine

1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine (PubChem CID 114245200) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine
PubChem CID114245200
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2ncc(C)cc2C)ncc1C
InChIInChI=1S/C14H18N4/c1-9-5-10(2)13(16-6-9)14-17-7-11(3)12(18-14)8-15-4/h5-7,15H,8H2,1-4H3
InChIKeyMFBUACLZIBDVAU-UHFFFAOYSA-N
XLogP2.18
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-chlorophenyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine
CID 114245218
5-bromo-2-(3,5-dimethyl-2-pyridinyl)-N-ethylpyrimidin-4-amine
CID 113365676
1-[2-(3,5-dimethyl-2-pyridinyl)-4-(methoxymethyl)-1,3-thiazol-5-yl]-N-methylmethanamine
CID 114365944
1-[4-cyclopropyl-2-(3,5-dimethyl-2-pyridinyl)-1,3-thiazol-5-yl]-N-methylmethanamine
CID 114366921
2-(3,5-dimethyl-2-pyridinyl)-4-ethyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740752
1-[3-(3,5-dimethyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-methylethanamine
CID 113365455
1-[2-(4,4-dimethylcyclohexyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine
CID 114245205
N-methyl-1-[5-methyl-2-(pyridin-2-ylmethyl)pyrimidin-4-yl]methanamine
CID 114245179
3-[3-(3,5-dimethyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-2-methylpropanenitrile
CID 106526680
5-[3-(3,5-dimethyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-methylpyrrole-3-carbonitrile
CID 104677156
N-methyl-1-[5-methyl-2-(2-methyloxan-2-yl)pyrimidin-4-yl]methanamine
CID 114245206
4-[3-(3,5-dimethyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-1H-pyrazole-5-carbonitrile
CID 136770964

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine (CID 114245200) is 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine is CNCc1nc(-c2ncc(C)cc2C)ncc1C.
What is the InChIKey of 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine?
The InChIKey is MFBUACLZIBDVAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-9-5-10(2)13(16-6-9)14-17-7-11(3)12(18-14)8-15-4/h5-7,15H,8H2,1-4H3.
What are the key properties of 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine?
1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine has a molecular weight of 242.33 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3,5-dimethyl-2-pyridinyl)-5-methylpyrimidin-4-yl]-N-methylmethanamine is sourced from PubChem (CID 114245200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).