2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine

C14H14IN5 — CID 66297754

IUPAC2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(-c2cn3ccccc3n2)nc(N)c1I
InChIInChI=1S/C14H14IN5/c1-8(2)12-11(15)13(16)19-14(18-12)9-7-20-6-4-3-5-10(20)17-9/h3-8H,1-2H3,(H2,16,18,19)
InChIKeyNMSRQWLDUJEBIC-UHFFFAOYSA-N
MW379.21 g/mol
LogP3.10
Rot. Bonds2

About 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine

2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine (PubChem CID 66297754) has the molecular formula C14H14IN5 and a molecular weight of 379.21 g/mol. Its IUPAC name is 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine
PubChem CID66297754
Molecular FormulaC14H14IN5
Molecular Weight379.21 g/mol
Exact Mass379.03
IUPAC Name2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(-c2cn3ccccc3n2)nc(N)c1I
InChIInChI=1S/C14H14IN5/c1-8(2)12-11(15)13(16)19-14(18-12)9-7-20-6-4-3-5-10(20)17-9/h3-8H,1-2H3,(H2,16,18,19)
InChIKeyNMSRQWLDUJEBIC-UHFFFAOYSA-N
XLogP3.10
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.21
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-2-imidazo[1,2-a]pyridin-2-yl-6-propylpyrimidin-4-amine
CID 66297292
2-[4-(4-methylphenyl)phenyl]imidazo[1,2-a]pyridine
CID 58880683
2-imidazo[1,2-a]pyridin-2-yl-4-propan-2-yl-1,3-thiazole-5-carboxylic acid
CID 114360697
(1S)-1-imidazo[1,2-a]pyridin-2-ylethanamine;dihydrochloride
CID 155970924
3-[1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)ethyl]-1,2-oxazol-5-amine
CID 139670510
5-iodo-6-propan-2-yl-2-quinolin-6-ylpyrimidin-4-amine
CID 66300911
2-fluoroimidazo[1,2-a]pyridine
CID 68592134
2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine
CID 22380806
3-imidazo[1,2-a]pyridin-2-yl-2-methylpropan-1-amine
CID 83877207
3-amino-4-imidazo[1,2-a]pyridin-2-ylpyrazole-1-carboxamide
CID 70501209
2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine
CID 735320
2-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 115403226

Frequently Asked Questions

What is the IUPAC name of 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine (CID 66297754) is 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine is CC(C)c1nc(-c2cn3ccccc3n2)nc(N)c1I.
What is the InChIKey of 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is NMSRQWLDUJEBIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14IN5/c1-8(2)12-11(15)13(16)19-14(18-12)9-7-20-6-4-3-5-10(20)17-9/h3-8H,1-2H3,(H2,16,18,19).
What are the key properties of 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine?
2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 379.21 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[1,2-a]pyridin-2-yl-5-iodo-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 66297754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).