4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine

C18H19N7O — CID 144697209

IUPAC4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine
SMILESC1=NC(c2[nH]nc3ccc(-c4ccn[nH]4)cc23)C=C(N2CCOCC2)N1
InChIInChI=1S/C18H19N7O/c1-2-15-13(9-12(1)14-3-4-21-22-14)18(24-23-15)16-10-17(20-11-19-16)25-5-7-26-8-6-25/h1-4,9-11,16H,5-8H2,(H,19,20)(H,21,22)(H,23,24)
InChIKeyKYBFWRYUILAJAG-UHFFFAOYSA-N
MW349.40 g/mol
LogP1.80
Rot. Bonds3

About 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine

4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine (PubChem CID 144697209) has the molecular formula C18H19N7O and a molecular weight of 349.40 g/mol. Its IUPAC name is 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine.

Molecular Properties

Compound Name4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine
PubChem CID144697209
Molecular FormulaC18H19N7O
Molecular Weight349.40 g/mol
Exact Mass349.17
IUPAC Name4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine
SMILESC1=NC(c2[nH]nc3ccc(-c4ccn[nH]4)cc23)C=C(N2CCOCC2)N1
InChIInChI=1S/C18H19N7O/c1-2-15-13(9-12(1)14-3-4-21-22-14)18(24-23-15)16-10-17(20-11-19-16)25-5-7-26-8-6-25/h1-4,9-11,16H,5-8H2,(H,19,20)(H,21,22)(H,23,24)
InChIKeyKYBFWRYUILAJAG-UHFFFAOYSA-N
XLogP1.80
TPSA94.22 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.40
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine with MolForge

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Related Compounds

3-[6-(4-methylsulfonylpiperazin-1-yl)-1,4-dihydropyrimidin-4-yl]-5-pyridin-3-yl-2H-indazole
CID 130372513
(2R)-4-[4-(5-ethoxy-2H-indazol-3-yl)-1,4-dihydropyrimidin-6-yl]-2-methylmorpholine
CID 90400233
2-morpholin-4-yl-6-[3-(1H-pyrazol-5-yl)phenyl]pyrimidin-4-amine
CID 29182338
(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxy-3-morpholin-4-ylpropan-2-ol
CID 137409151
4-[4-(6-fluoro-3-pyridinyl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
CID 118869521
4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine
CID 50982860
morpholine;5-phenyl-1H-pyrazole
CID 71270816
4-[3-[3-phenyl-2-(1H-pyrazol-5-yl)imidazo[4,5-b]pyridin-5-yl]phenyl]morpholine
CID 71138371
4-[4-phenyl-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
CID 118869383
1-[4-(1H-pyrazol-5-yl)-2-pyridinyl]piperazine
CID 105486911
2-[(3-methylidenemorpholin-4-yl)methyl]-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-4-amine;2-[(2-methylidenepiperidin-1-yl)methyl]-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-4-amine
CID 160902821
(3S)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]pyrrolidin-3-ol
CID 137417600

Frequently Asked Questions

What is the IUPAC name of 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine?
The IUPAC name of 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine (CID 144697209) is 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine.
What is the SMILES notation for 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine?
The canonical SMILES for 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine is C1=NC(c2[nH]nc3ccc(-c4ccn[nH]4)cc23)C=C(N2CCOCC2)N1.
What is the InChIKey of 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine?
The InChIKey is KYBFWRYUILAJAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7O/c1-2-15-13(9-12(1)14-3-4-21-22-14)18(24-23-15)16-10-17(20-11-19-16)25-5-7-26-8-6-25/h1-4,9-11,16H,5-8H2,(H,19,20)(H,21,22)(H,23,24).
What are the key properties of 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine?
4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine has a molecular weight of 349.40 g/mol, XLogP of 1.80, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[5-(1H-pyrazol-5-yl)-2H-indazol-3-yl]-1,4-dihydropyrimidin-6-yl]morpholine is sourced from PubChem (CID 144697209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).