7-propan-2-ylimidazo[1,2-a]pyrimidine

C9H11N3 — CID 18001276

IUPAC7-propan-2-ylimidazo[1,2-a]pyrimidine
SMILESCC(C)c1ccn2ccnc2n1
InChIInChI=1S/C9H11N3/c1-7(2)8-3-5-12-6-4-10-9(12)11-8/h3-7H,1-2H3
InChIKeyRTIWAVIMADQWTA-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.85
Rot. Bonds1

About 7-propan-2-ylimidazo[1,2-a]pyrimidine

7-propan-2-ylimidazo[1,2-a]pyrimidine (PubChem CID 18001276) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 7-propan-2-ylimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name7-propan-2-ylimidazo[1,2-a]pyrimidine
PubChem CID18001276
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name7-propan-2-ylimidazo[1,2-a]pyrimidine
SMILESCC(C)c1ccn2ccnc2n1
InChIInChI=1S/C9H11N3/c1-7(2)8-3-5-12-6-4-10-9(12)11-8/h3-7H,1-2H3
InChIKeyRTIWAVIMADQWTA-UHFFFAOYSA-N
XLogP1.85
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Tert-butyl-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyrimidine
CID 122183040
2-Tert-butyl-7-methyl-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyrimidine
CID 122183042
4-imidazo[1,2-a]pyrimidin-3-yl-N,N-dimethylpyrimidin-2-amine
CID 164622513
2-Imidazol-1-yl-4,6-dimethylpyrimidine
CID 11206064
N-butyl-2-isobutyl-5,7-dimethylimidazo[1,2-a]pyrimidin-3-amine
CID 53301198
4-Isopropyl-N,N-dimethylpyrimidin-2-amine
CID 10820941
2-Imidazo[1,2-a]pyrimidin-7-yl-propan-2-ol
CID 11469394
4-Isobutylpyrimidine
CID 565104
2-(Chloromethyl)-5,7-dimethylimidazo[1,2-a]pyrimidine
CID 693330
2-(2-Amino-2-methylprop-1-yl)imidazo[1,2-a]pyridine
CID 21036918
N,4,6-trimethyl-N-[2-(2-methylimidazol-1-yl)ethyl]pyrimidin-2-amine
CID 46958595
4-cyclobutyl-6-methyl-2-{4-[(1-methyl-1H-imidazol-2-yl)methyl]piperazin-1-yl}pyrimidine
CID 56873336

Frequently Asked Questions

What is the IUPAC name of 7-propan-2-ylimidazo[1,2-a]pyrimidine?
The IUPAC name of 7-propan-2-ylimidazo[1,2-a]pyrimidine (CID 18001276) is 7-propan-2-ylimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 7-propan-2-ylimidazo[1,2-a]pyrimidine?
The canonical SMILES for 7-propan-2-ylimidazo[1,2-a]pyrimidine is CC(C)c1ccn2ccnc2n1.
What is the InChIKey of 7-propan-2-ylimidazo[1,2-a]pyrimidine?
The InChIKey is RTIWAVIMADQWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-7(2)8-3-5-12-6-4-10-9(12)11-8/h3-7H,1-2H3.
What are the key properties of 7-propan-2-ylimidazo[1,2-a]pyrimidine?
7-propan-2-ylimidazo[1,2-a]pyrimidine has a molecular weight of 161.21 g/mol, XLogP of 1.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propan-2-ylimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 18001276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).