N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine

C14H19N3O — CID 62914017

IUPACN,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine
SMILESCNc1nc(-c2ccc(C)o2)nc(C)c1C(C)C
InChIInChI=1S/C14H19N3O/c1-8(2)12-10(4)16-13(17-14(12)15-5)11-7-6-9(3)18-11/h6-8H,1-5H3,(H,15,16,17)
InChIKeyBELMXFQAXILFKJ-UHFFFAOYSA-N
MW245.33 g/mol
LogP3.52
Rot. Bonds3

About N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine

N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine (PubChem CID 62914017) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine
PubChem CID62914017
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine
SMILESCNc1nc(-c2ccc(C)o2)nc(C)c1C(C)C
InChIInChI=1S/C14H19N3O/c1-8(2)12-10(4)16-13(17-14(12)15-5)11-7-6-9(3)18-11/h6-8H,1-5H3,(H,15,16,17)
InChIKeyBELMXFQAXILFKJ-UHFFFAOYSA-N
XLogP3.52
TPSA50.95 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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-fluoro-N,6-dimethyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine
CID 66000214
[5,6-dimethyl-2-(5-methylfuran-2-yl)pyrimidin-4-yl]hydrazine
CID 62250569
2-(3,4-dimethylphenyl)-N,6-dimethyl-5-propan-2-ylpyrimidin-4-amine
CID 63480343
N,6-dimethyl-2-(3-methyl-2-pyridinyl)-5-propan-2-ylpyrimidin-4-amine
CID 62915108
5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine
CID 66297025
2-(4-bromothiophen-2-yl)-N,6-dimethyl-5-propan-2-ylpyrimidin-4-amine
CID 63481025
4-(methylamino)-2-(5-methylfuran-2-yl)pyrimidine-5-carboxylic acid
CID 116864985
2-(5-ethylfuran-2-yl)-N,5,6-trimethylpyrimidin-4-amine
CID 62344723
2-(4-chloro-2-methoxyphenyl)-N,6-dimethyl-5-propan-2-ylpyrimidin-4-amine
CID 106819693
2-methoxy-5-[4-methyl-6-(methylamino)-5-propan-2-ylpyrimidin-2-yl]phenol
CID 62913656
N-methyl-1-[3-(5-methylfuran-2-yl)-1,2,4-oxadiazol-5-yl]propan-2-amine
CID 115081497
N-methyl-1-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]ethanamine
CID 61282283

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine (CID 62914017) is N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine is CNc1nc(-c2ccc(C)o2)nc(C)c1C(C)C.
What is the InChIKey of N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is BELMXFQAXILFKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-8(2)12-10(4)16-13(17-14(12)15-5)11-7-6-9(3)18-11/h6-8H,1-5H3,(H,15,16,17).
What are the key properties of N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine?
N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 245.33 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 62914017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).