1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea

C18H18N8O — CID 68901370

IUPAC1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea
SMILESCCNC(=O)Nc1cn2c(-c3cnn(C)c3)nc(-c3cccnc3)cc2n1
InChIInChI=1S/C18H18N8O/c1-3-20-18(27)24-15-11-26-16(23-15)7-14(12-5-4-6-19-8-12)22-17(26)13-9-21-25(2)10-13/h4-11H,3H2,1-2H3,(H2,20,24,27)
InChIKeyNSHTZSYFODOYTL-UHFFFAOYSA-N
MW362.40 g/mol
LogP2.33
Rot. Bonds4

About 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea

1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea (PubChem CID 68901370) has the molecular formula C18H18N8O and a molecular weight of 362.40 g/mol. Its IUPAC name is 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea.

Molecular Properties

Compound Name1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea
PubChem CID68901370
Molecular FormulaC18H18N8O
Molecular Weight362.40 g/mol
Exact Mass362.16
IUPAC Name1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea
SMILESCCNC(=O)Nc1cn2c(-c3cnn(C)c3)nc(-c3cccnc3)cc2n1
InChIInChI=1S/C18H18N8O/c1-3-20-18(27)24-15-11-26-16(23-15)7-14(12-5-4-6-19-8-12)22-17(26)13-9-21-25(2)10-13/h4-11H,3H2,1-2H3,(H2,20,24,27)
InChIKeyNSHTZSYFODOYTL-UHFFFAOYSA-N
XLogP2.33
TPSA102.03 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea with MolForge

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Related Compounds

1-[5-(cyclopropanecarbonyl)-7-pyridin-3-ylimidazo[1,2-a]pyridin-2-yl]-3-ethylurea
CID 68901891
1-ethyl-3-[5-(5-methylpyrimidin-2-yl)-7-pyridin-3-ylimidazo[1,2-a]pyridin-2-yl]urea
CID 44555361
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CID 45484816
1-ethyl-3-[5-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]-7-pyridin-3-ylimidazo[1,2-a]pyridin-2-yl]urea
CID 45484763
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CID 91596822
1-ethyl-3-(5-pyridin-3-yl-2-pyridinyl)urea
CID 72712074
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CID 71232480
1-[5-(2,3-dimethylimidazol-4-yl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-3-ethylurea
CID 68839047
1-ethyl-3-(5-propanoyl-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)urea
CID 68835563
1-ethyl-3-(5-pyrazol-1-yl-7-pyridin-3-yl-1,3-benzothiazol-2-yl)urea
CID 24864398
CID 89324885
CID 89324885
ethane;1-ethyl-3-(7-methyl-5-pyridin-3-yl-1,3-benzothiazol-2-yl)urea
CID 143598440

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea?
The IUPAC name of 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea (CID 68901370) is 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea.
What is the SMILES notation for 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea?
The canonical SMILES for 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea is CCNC(=O)Nc1cn2c(-c3cnn(C)c3)nc(-c3cccnc3)cc2n1.
What is the InChIKey of 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea?
The InChIKey is NSHTZSYFODOYTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N8O/c1-3-20-18(27)24-15-11-26-16(23-15)7-14(12-5-4-6-19-8-12)22-17(26)13-9-21-25(2)10-13/h4-11H,3H2,1-2H3,(H2,20,24,27).
What are the key properties of 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea?
1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea has a molecular weight of 362.40 g/mol, XLogP of 2.33, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[5-(1-methylpyrazol-4-yl)-7-pyridin-3-ylimidazo[1,2-c]pyrimidin-2-yl]urea is sourced from PubChem (CID 68901370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).