2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine

C14H19N3O — CID 116892858

IUPAC2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine
SMILESCc1cc(-c2ccc(C)o2)nc(CC(C)(C)N)n1
InChIInChI=1S/C14H19N3O/c1-9-7-11(12-6-5-10(2)18-12)17-13(16-9)8-14(3,4)15/h5-7H,8,15H2,1-4H3
InChIKeyHHXRGNQFQGUASE-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.63
Rot. Bonds3

About 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine

2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine (PubChem CID 116892858) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine
PubChem CID116892858
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine
SMILESCc1cc(-c2ccc(C)o2)nc(CC(C)(C)N)n1
InChIInChI=1S/C14H19N3O/c1-9-7-11(12-6-5-10(2)18-12)17-13(16-9)8-14(3,4)15/h5-7H,8,15H2,1-4H3
InChIKeyHHXRGNQFQGUASE-UHFFFAOYSA-N
XLogP2.63
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(chloromethyl)-4-methyl-6-(5-methylfuran-2-yl)pyrimidine
CID 116893719
N-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]methanamine
CID 116892451
2-methyl-3-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propanoic acid
CID 116894252
2-bromo-4-methyl-6-(5-methylfuran-2-yl)pyrimidine
CID 116897330
2,2-dimethyl-3-[4-(5-methylfuran-2-yl)-1,3-thiazol-2-yl]propan-1-amine
CID 116965222
4-methyl-6-(5-methylfuran-2-yl)pyrimidine-2-carboxylic acid
CID 116894066
4-(5-methylfuran-2-yl)-2-(2,2,2-trifluoroethyl)-1,3-thiazole
CID 116969911
1-(4-cyclopentyl-6-methylpyrimidin-2-yl)-2-methylpropan-2-amine
CID 116892859
methyl 4-methyl-6-(5-methylfuran-2-yl)pyrimidine-2-carboxylate
CID 116895233
[4-(5-methylfuran-2-yl)pyrimidin-2-yl]methanol
CID 116899503
2-bromo-4-(5-methylfuran-2-yl)-1,3-thiazole
CID 112623649
1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]cyclobutane-1-carbonitrile
CID 116896131

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine?
The IUPAC name of 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine (CID 116892858) is 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine.
What is the SMILES notation for 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine?
The canonical SMILES for 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine is Cc1cc(-c2ccc(C)o2)nc(CC(C)(C)N)n1.
What is the InChIKey of 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine?
The InChIKey is HHXRGNQFQGUASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-9-7-11(12-6-5-10(2)18-12)17-13(16-9)8-14(3,4)15/h5-7H,8,15H2,1-4H3.
What are the key properties of 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine?
2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine has a molecular weight of 245.33 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[4-methyl-6-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-2-amine is sourced from PubChem (CID 116892858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).