1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea

C18H21N7O — CID 70815049

IUPAC1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea
SMILESCC(C)n1ccc(-c2cnc3ccc(NC(=O)NCC4CC4)nc3n2)n1
InChIInChI=1S/C18H21N7O/c1-11(2)25-8-7-13(24-25)15-10-19-14-5-6-16(22-17(14)21-15)23-18(26)20-9-12-3-4-12/h5-8,10-12H,3-4,9H2,1-2H3,(H2,20,21,22,23,26)
InChIKeyJXFVTQANEWSPBM-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.00
Rot. Bonds5

About 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea

1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea (PubChem CID 70815049) has the molecular formula C18H21N7O and a molecular weight of 351.41 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea
PubChem CID70815049
Molecular FormulaC18H21N7O
Molecular Weight351.41 g/mol
Exact Mass351.18
IUPAC Name1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea
SMILESCC(C)n1ccc(-c2cnc3ccc(NC(=O)NCC4CC4)nc3n2)n1
InChIInChI=1S/C18H21N7O/c1-11(2)25-8-7-13(24-25)15-10-19-14-5-6-16(22-17(14)21-15)23-18(26)20-9-12-3-4-12/h5-8,10-12H,3-4,9H2,1-2H3,(H2,20,21,22,23,26)
InChIKeyJXFVTQANEWSPBM-UHFFFAOYSA-N
XLogP3.00
TPSA97.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea with MolForge

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Related Compounds

1-{1-[8-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)-9-methyl-9H-purin-6-yl]piperidin-4-yl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one
CID 66802145
Irak4-IN-6
CID 139582017
2-[4-[(1-Methylcyclopropyl)amino]-2-[(1-methylpyrazol-4-yl)amino]pyrido[3,2-d]pyrimidin-6-yl]ethanenitrile
CID 154815577
1-Benzyl-3-[7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]urea
CID 52936268
1-Tert-butyl-3-[7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]urea
CID 53236670
1-[7-(1-Methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-3-phenylurea
CID 53236671
1-[7-(1-Methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-3-(2-phenylethyl)urea
CID 53239587
1-Cyclopropyl-3-[[1-(3-methylbutyl)imidazo[4,5-b]pyridin-2-yl]methyl]imidazo[4,5-c]pyridin-2-one
CID 57378654
N-[2-methyl-6-[2-[(1-methylpyrazol-3-yl)amino]imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]acetamide
CID 62706655
7-(1-methylpyrazol-4-yl)-N-[[(3S)-piperidin-3-yl]methyl]pyrido[3,4-b]pyrazin-5-amine
CID 68309299
1-[2-(2-Methylpyrazol-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea
CID 149799889
1-[6-(4-Propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]-3-pyrazolo[1,5-a]pyridin-2-ylurea
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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea?
The IUPAC name of 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea (CID 70815049) is 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea.
What is the SMILES notation for 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea?
The canonical SMILES for 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea is CC(C)n1ccc(-c2cnc3ccc(NC(=O)NCC4CC4)nc3n2)n1.
What is the InChIKey of 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea?
The InChIKey is JXFVTQANEWSPBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N7O/c1-11(2)25-8-7-13(24-25)15-10-19-14-5-6-16(22-17(14)21-15)23-18(26)20-9-12-3-4-12/h5-8,10-12H,3-4,9H2,1-2H3,(H2,20,21,22,23,26).
What are the key properties of 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea?
1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea has a molecular weight of 351.41 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-3-[3-(1-propan-2-ylpyrazol-3-yl)pyrido[2,3-b]pyrazin-6-yl]urea is sourced from PubChem (CID 70815049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).