7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one

C11H16N4O — CID 10013741

IUPAC7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one
SMILESCCCCCn1ccn2c(=O)cc(N)nc12
InChIInChI=1S/C11H16N4O/c1-2-3-4-5-14-6-7-15-10(16)8-9(12)13-11(14)15/h6-8H,2-5,12H2,1H3
InChIKeyCWPAKPPSUVQHBB-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.27
Rot. Bonds4

About 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one

7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one (PubChem CID 10013741) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one
PubChem CID10013741
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one
SMILESCCCCCn1ccn2c(=O)cc(N)nc12
InChIInChI=1S/C11H16N4O/c1-2-3-4-5-14-6-7-15-10(16)8-9(12)13-11(14)15/h6-8H,2-5,12H2,1H3
InChIKeyCWPAKPPSUVQHBB-UHFFFAOYSA-N
XLogP1.27
TPSA65.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Mklvwfihwurrqa-uhfffaoysa-
CID 10082230
Lyozlazjdljdbn-uhfffaoysa-
CID 10263477
7-Chloro-1-hexylimidazo[1,2-a]pyrimidin-5-one
CID 10060844
Rivlvkkwiiobke-uhfffaoysa-
CID 10376739
Ytkslrqthvjafk-uhfffaoysa-
CID 10399364
1-(6-oxo-1H-pyrimidin-2-yl)-3-pentylurea
CID 20768403
1-hexyl-3-(6-oxo-1H-pyrimidin-2-yl)urea
CID 53748153
2-Amino-3-butyl-6-(diethylamino)pyrimidin-4-one
CID 12502637
2-Amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one
CID 84676232
1-(6-Isocyanatohexyl)-3-(1-methyl-4-oxopyrimidin-2-yl)urea
CID 102208811
CID 177551080
CID 177551080

Frequently Asked Questions

What is the IUPAC name of 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one (CID 10013741) is 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one is CCCCCn1ccn2c(=O)cc(N)nc12.
What is the InChIKey of 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one?
The InChIKey is CWPAKPPSUVQHBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-2-3-4-5-14-6-7-15-10(16)8-9(12)13-11(14)15/h6-8H,2-5,12H2,1H3.
What are the key properties of 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one?
7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one has a molecular weight of 220.28 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-1-pentylimidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 10013741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).