2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine

C12H15N5 — CID 66161729

IUPAC2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine
SMILESCCc1cc(N)nc(-c2cncn2C2CC2)n1
InChIInChI=1S/C12H15N5/c1-2-8-5-11(13)16-12(15-8)10-6-14-7-17(10)9-3-4-9/h5-7,9H,2-4H2,1H3,(H2,13,15,16)
InChIKeyXMZIOAQRKKDMNV-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.82
Rot. Bonds3

About 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine

2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine (PubChem CID 66161729) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine
PubChem CID66161729
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine
SMILESCCc1cc(N)nc(-c2cncn2C2CC2)n1
InChIInChI=1S/C12H15N5/c1-2-8-5-11(13)16-12(15-8)10-6-14-7-17(10)9-3-4-9/h5-7,9H,2-4H2,1H3,(H2,13,15,16)
InChIKeyXMZIOAQRKKDMNV-UHFFFAOYSA-N
XLogP1.82
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-2-(3-cyclopropylimidazol-4-yl)-6-propylpyrimidin-4-amine
CID 66295944
[2-(3-cyclopropylimidazol-4-yl)-6-(methoxymethyl)pyrimidin-4-yl]hydrazine
CID 66164316
2-(3-cyclopropylimidazol-4-yl)-N-ethyl-6-propan-2-ylpyrimidin-4-amine
CID 66163526
5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine
CID 66164499
5-bromo-4,6-dichloro-2-(3-cyclopropylimidazol-4-yl)pyrimidine
CID 66312994
2-(3-cyclopropylimidazol-4-yl)-N-ethyl-5-iodo-6-propan-2-ylpyrimidin-4-amine
CID 66296221
5-bromo-2-(3-cyclopropylimidazol-4-yl)-N-ethyl-6-propylpyrimidin-4-amine
CID 66295755
4-chloro-6-cyclopropyl-2-(3-cyclopropylimidazol-4-yl)pyrimidine
CID 66163099
5-bromo-4-chloro-2-(3-cyclopropylimidazol-4-yl)-6-propan-2-ylpyrimidine
CID 66311681
5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-prop-2-ynylimidazol-4-amine
CID 66164696
6-(3-cyclopropylimidazol-4-yl)-5-ethyl-4,5-dihydropyridazin-3-amine
CID 66164739
4-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazole-1,5-diamine
CID 66163524

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine?
The IUPAC name of 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine (CID 66161729) is 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine.
What is the SMILES notation for 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine?
The canonical SMILES for 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine is CCc1cc(N)nc(-c2cncn2C2CC2)n1.
What is the InChIKey of 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine?
The InChIKey is XMZIOAQRKKDMNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-2-8-5-11(13)16-12(15-8)10-6-14-7-17(10)9-3-4-9/h5-7,9H,2-4H2,1H3,(H2,13,15,16).
What are the key properties of 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine?
2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine has a molecular weight of 229.29 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropylimidazol-4-yl)-6-ethylpyrimidin-4-amine is sourced from PubChem (CID 66161729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).