2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one

C18H18N6O — CID 134810477

IUPAC2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one
SMILESCn1cc(-c2cn(C)c(=O)n3cc(CNc4ccccc4)nc23)cn1
InChIInChI=1S/C18H18N6O/c1-22-12-16(13-8-20-23(2)10-13)17-21-15(11-24(17)18(22)25)9-19-14-6-4-3-5-7-14/h3-8,10-12,19H,9H2,1-2H3
InChIKeySXSQGCKNAUROCJ-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.05
Rot. Bonds4

About 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one

2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one (PubChem CID 134810477) has the molecular formula C18H18N6O and a molecular weight of 334.38 g/mol. Its IUPAC name is 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one.

Molecular Properties

Compound Name2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one
PubChem CID134810477
Molecular FormulaC18H18N6O
Molecular Weight334.38 g/mol
Exact Mass334.15
IUPAC Name2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one
SMILESCn1cc(-c2cn(C)c(=O)n3cc(CNc4ccccc4)nc23)cn1
InChIInChI=1S/C18H18N6O/c1-22-12-16(13-8-20-23(2)10-13)17-21-15(11-24(17)18(22)25)9-19-14-6-4-3-5-7-14/h3-8,10-12,19H,9H2,1-2H3
InChIKeySXSQGCKNAUROCJ-UHFFFAOYSA-N
XLogP2.05
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one?
The IUPAC name of 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one (CID 134810477) is 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one.
What is the SMILES notation for 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one?
The canonical SMILES for 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one is Cn1cc(-c2cn(C)c(=O)n3cc(CNc4ccccc4)nc23)cn1.
What is the InChIKey of 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one?
The InChIKey is SXSQGCKNAUROCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O/c1-22-12-16(13-8-20-23(2)10-13)17-21-15(11-24(17)18(22)25)9-19-14-6-4-3-5-7-14/h3-8,10-12,19H,9H2,1-2H3.
What are the key properties of 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one?
2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one has a molecular weight of 334.38 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(anilinomethyl)-6-methyl-8-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-one is sourced from PubChem (CID 134810477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).