2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid

C10H15N3O2 — CID 136995515

IUPAC2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid
SMILESCCCc1nc2n(c1C(=O)O)CCCN2
InChIInChI=1S/C10H15N3O2/c1-2-4-7-8(9(14)15)13-6-3-5-11-10(13)12-7/h2-6H2,1H3,(H,11,12)(H,14,15)
InChIKeyLEDIQQHSWRVEKG-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.35
Rot. Bonds3

About 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid

2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid (PubChem CID 136995515) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid.

Molecular Properties

Compound Name2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid
PubChem CID136995515
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid
SMILESCCCc1nc2n(c1C(=O)O)CCCN2
InChIInChI=1S/C10H15N3O2/c1-2-4-7-8(9(14)15)13-6-3-5-11-10(13)12-7/h2-6H2,1H3,(H,11,12)(H,14,15)
InChIKeyLEDIQQHSWRVEKG-UHFFFAOYSA-N
XLogP1.35
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid?
The IUPAC name of 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid (CID 136995515) is 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid.
What is the SMILES notation for 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid?
The canonical SMILES for 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid is CCCc1nc2n(c1C(=O)O)CCCN2.
What is the InChIKey of 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid?
The InChIKey is LEDIQQHSWRVEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-2-4-7-8(9(14)15)13-6-3-5-11-10(13)12-7/h2-6H2,1H3,(H,11,12)(H,14,15).
What are the key properties of 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid?
2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid has a molecular weight of 209.25 g/mol, XLogP of 1.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-3-carboxylic acid is sourced from PubChem (CID 136995515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).