1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide

C15H21N5O — CID 110197141

IUPAC1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide
SMILESCc1cc(C(=O)NCC2Cn3cccc3CN2C)nn1C
InChIInChI=1S/C15H21N5O/c1-11-7-14(17-19(11)3)15(21)16-8-13-10-20-6-4-5-12(20)9-18(13)2/h4-7,13H,8-10H2,1-3H3,(H,16,21)
InChIKeyWPZYZHPCHQJVPC-UHFFFAOYSA-N
MW287.37 g/mol
LogP0.77
Rot. Bonds3

About 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide

1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide (PubChem CID 110197141) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide
PubChem CID110197141
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide
SMILESCc1cc(C(=O)NCC2Cn3cccc3CN2C)nn1C
InChIInChI=1S/C15H21N5O/c1-11-7-14(17-19(11)3)15(21)16-8-13-10-20-6-4-5-12(20)9-18(13)2/h4-7,13H,8-10H2,1-3H3,(H,16,21)
InChIKeyWPZYZHPCHQJVPC-UHFFFAOYSA-N
XLogP0.77
TPSA55.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide with MolForge

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Related Compounds

2-(pyridin-4-yl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 25190898
N-hydroxy-5-(1-methylpyrrole-2-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
CID 58465584
US10022354, Example 200
CID 132070229
1-methyl-N-(pyridin-3-yl)-1H-pyrazole-5-carboxamide
CID 649594
Ethyl 4-(pyrazolo[1,5-a]pyridine-2-carbonylamino)piperidine-1-carboxylate
CID 5307919
(E)-3-methyl-N'-(pyridin-2-ylmethylene)-1H-pyrazole-5-carbohydrazide
CID 6886509
N-[4-[[(1R)-4-ethynylcyclohex-3-en-1-yl]-propylamino]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 71734028
N-[4-[[(1S)-4-ethynylcyclohex-3-en-1-yl]-propylamino]butyl]pyrazolo[1,5-a]pyridine-2-carboxamide
CID 71734126
5-tert-butyl-1-pentyl-N-pyridin-4-ylpyrazole-3-carboxamide
CID 162668719
N-(1-phenylethyl)pyrazolo[1,5-a]pyridine-2-carboxamide
CID 16024869
3-methyl-N'-[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]-1H-pyrazole-5-carbohydrazide
CID 6867363
1H-Pyrazole-3-carboxylic acid (1-methyl-1H-pyrrol-2-ylmethylene)-hydrazide
CID 9556567

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide?
The IUPAC name of 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide (CID 110197141) is 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide.
What is the SMILES notation for 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide?
The canonical SMILES for 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide is Cc1cc(C(=O)NCC2Cn3cccc3CN2C)nn1C.
What is the InChIKey of 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide?
The InChIKey is WPZYZHPCHQJVPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-11-7-14(17-19(11)3)15(21)16-8-13-10-20-6-4-5-12(20)9-18(13)2/h4-7,13H,8-10H2,1-3H3,(H,16,21).
What are the key properties of 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide?
1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-[(2-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-3-yl)methyl]pyrazole-3-carboxamide is sourced from PubChem (CID 110197141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).