N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide

C12H20N4O2 — CID 136994527

IUPACN-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCOC(C)(C)CNC(=O)c1cn2c(n1)NCCC2
InChIInChI=1S/C12H20N4O2/c1-12(2,18-3)8-14-10(17)9-7-16-6-4-5-13-11(16)15-9/h7H,4-6,8H2,1-3H3,(H,13,15)(H,14,17)
InChIKeyZEEMVWHJRLCUFE-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.85
Rot. Bonds4

About N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide

N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide (PubChem CID 136994527) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
PubChem CID136994527
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC NameN-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCOC(C)(C)CNC(=O)c1cn2c(n1)NCCC2
InChIInChI=1S/C12H20N4O2/c1-12(2,18-3)8-14-10(17)9-7-16-6-4-5-13-11(16)15-9/h7H,4-6,8H2,1-3H3,(H,13,15)(H,14,17)
InChIKeyZEEMVWHJRLCUFE-UHFFFAOYSA-N
XLogP0.85
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide?
The IUPAC name of N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide (CID 136994527) is N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide is COC(C)(C)CNC(=O)c1cn2c(n1)NCCC2.
What is the InChIKey of N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide?
The InChIKey is ZEEMVWHJRLCUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-12(2,18-3)8-14-10(17)9-7-16-6-4-5-13-11(16)15-9/h7H,4-6,8H2,1-3H3,(H,13,15)(H,14,17).
What are the key properties of N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide?
N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-methylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 136994527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).