1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide

C15H20N6O — CID 118774175

IUPAC1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide
SMILESCC(C)C(NC(=O)c1cnn2ccn(C)c12)c1nccn1C
InChIInChI=1S/C15H20N6O/c1-10(2)12(13-16-5-6-19(13)3)18-14(22)11-9-17-21-8-7-20(4)15(11)21/h5-10,12H,1-4H3,(H,18,22)
InChIKeyVNWOGJCSZRRYJE-UHFFFAOYSA-N
MW300.37 g/mol
LogP1.53
Rot. Bonds4

About 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide

1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide (PubChem CID 118774175) has the molecular formula C15H20N6O and a molecular weight of 300.37 g/mol. Its IUPAC name is 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide
PubChem CID118774175
Molecular FormulaC15H20N6O
Molecular Weight300.37 g/mol
Exact Mass300.17
IUPAC Name1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide
SMILESCC(C)C(NC(=O)c1cnn2ccn(C)c12)c1nccn1C
InChIInChI=1S/C15H20N6O/c1-10(2)12(13-16-5-6-19(13)3)18-14(22)11-9-17-21-8-7-20(4)15(11)21/h5-10,12H,1-4H3,(H,18,22)
InChIKeyVNWOGJCSZRRYJE-UHFFFAOYSA-N
XLogP1.53
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide?
The IUPAC name of 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide (CID 118774175) is 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide.
What is the SMILES notation for 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide?
The canonical SMILES for 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide is CC(C)C(NC(=O)c1cnn2ccn(C)c12)c1nccn1C.
What is the InChIKey of 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide?
The InChIKey is VNWOGJCSZRRYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O/c1-10(2)12(13-16-5-6-19(13)3)18-14(22)11-9-17-21-8-7-20(4)15(11)21/h5-10,12H,1-4H3,(H,18,22).
What are the key properties of 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide?
1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide has a molecular weight of 300.37 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]imidazo[2,1-e]pyrazole-7-carboxamide is sourced from PubChem (CID 118774175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).