6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine

C16H25N5 — CID 80974842

IUPAC6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
SMILESCCCNc1nc(CCC)nc(-c2nccn2CC)c1C
InChIInChI=1S/C16H25N5/c1-5-8-13-19-14(16-18-10-11-21(16)7-3)12(4)15(20-13)17-9-6-2/h10-11H,5-9H2,1-4H3,(H,17,19,20)
InChIKeyJHTDFDFYOJIHCX-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.44
Rot. Bonds7

About 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine

6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine (PubChem CID 80974842) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
PubChem CID80974842
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC Name6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
SMILESCCCNc1nc(CCC)nc(-c2nccn2CC)c1C
InChIInChI=1S/C16H25N5/c1-5-8-13-19-14(16-18-10-11-21(16)7-3)12(4)15(20-13)17-9-6-2/h10-11H,5-9H2,1-4H3,(H,17,19,20)
InChIKeyJHTDFDFYOJIHCX-UHFFFAOYSA-N
XLogP3.44
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-6-(1-ethylimidazol-2-yl)-5-methyl-2-propylpyrimidin-4-amine
CID 80976649
2-ethyl-6-(1-ethylimidazol-2-yl)-N,5-dimethylpyrimidin-4-amine
CID 80977310
5-methyl-6-(1-methylpyrazol-3-yl)-N,2-dipropylpyrimidin-4-amine
CID 103132116
6-(2-ethylimidazol-1-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
CID 80991668
6-(4-fluorophenyl)-5-methyl-N,2-dipropylpyrimidin-4-amine
CID 80977523
6-(4-chlorophenyl)-5-methyl-N,2-dipropylpyrimidin-4-amine
CID 80969852
5-methyl-N,2-dipropyl-6-thiophen-3-ylpyrimidin-4-amine
CID 80976401
4-chloro-2-ethyl-6-(1-ethylimidazol-2-yl)-5-methylpyrimidine
CID 80975109
N-ethyl-5-methyl-6-(2-methylimidazol-1-yl)-2-propylpyrimidin-4-amine
CID 80992338
4-N-[2-(dimethylamino)ethyl]-5-methyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80980867
2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine
CID 80974848
6-(4-iodopyrazol-1-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
CID 80988536

Frequently Asked Questions

What is the IUPAC name of 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine?
The IUPAC name of 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine (CID 80974842) is 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine.
What is the SMILES notation for 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine?
The canonical SMILES for 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine is CCCNc1nc(CCC)nc(-c2nccn2CC)c1C.
What is the InChIKey of 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine?
The InChIKey is JHTDFDFYOJIHCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-5-8-13-19-14(16-18-10-11-21(16)7-3)12(4)15(20-13)17-9-6-2/h10-11H,5-9H2,1-4H3,(H,17,19,20).
What are the key properties of 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine?
6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine has a molecular weight of 287.41 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-ethylimidazol-2-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine is sourced from PubChem (CID 80974842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).