N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide

C16H13N5O3 — CID 56757774

IUPACN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide
SMILESCc1nc2ncccn2c1C(=O)NCc1cc(-c2ccco2)on1
InChIInChI=1S/C16H13N5O3/c1-10-14(21-6-3-5-17-16(21)19-10)15(22)18-9-11-8-13(24-20-11)12-4-2-7-23-12/h2-8H,9H2,1H3,(H,18,22)
InChIKeyHPWFUUJLFBLICE-UHFFFAOYSA-N
MW323.31 g/mol
LogP2.22
Rot. Bonds4

About N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide

N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide (PubChem CID 56757774) has the molecular formula C16H13N5O3 and a molecular weight of 323.31 g/mol. Its IUPAC name is N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide
PubChem CID56757774
Molecular FormulaC16H13N5O3
Molecular Weight323.31 g/mol
Exact Mass323.10
IUPAC NameN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide
SMILESCc1nc2ncccn2c1C(=O)NCc1cc(-c2ccco2)on1
InChIInChI=1S/C16H13N5O3/c1-10-14(21-6-3-5-17-16(21)19-10)15(22)18-9-11-8-13(24-20-11)12-4-2-7-23-12/h2-8H,9H2,1H3,(H,18,22)
InChIKeyHPWFUUJLFBLICE-UHFFFAOYSA-N
XLogP2.22
TPSA98.46 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.31
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide (CID 56757774) is N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide is Cc1nc2ncccn2c1C(=O)NCc1cc(-c2ccco2)on1.
What is the InChIKey of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is HPWFUUJLFBLICE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N5O3/c1-10-14(21-6-3-5-17-16(21)19-10)15(22)18-9-11-8-13(24-20-11)12-4-2-7-23-12/h2-8H,9H2,1H3,(H,18,22).
What are the key properties of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide?
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 323.31 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 56757774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).