6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide

C19H17N5O3 — CID 69179636

IUPAC6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide
SMILESCC1=C(C(N)=O)C(c2ccc(O)cc2)NC(=O)N1c1ccc2[nH]ncc2c1
InChIInChI=1S/C19H17N5O3/c1-10-16(18(20)26)17(11-2-5-14(25)6-3-11)22-19(27)24(10)13-4-7-15-12(8-13)9-21-23-15/h2-9,17,25H,1H3,(H2,20,26)(H,21,23)(H,22,27)
InChIKeyMWMXTBNMSOITNP-UHFFFAOYSA-N
MW363.38 g/mol
LogP2.30
Rot. Bonds3

About 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide

6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide (PubChem CID 69179636) has the molecular formula C19H17N5O3 and a molecular weight of 363.38 g/mol. Its IUPAC name is 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide.

Molecular Properties

Compound Name6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide
PubChem CID69179636
Molecular FormulaC19H17N5O3
Molecular Weight363.38 g/mol
Exact Mass363.13
IUPAC Name6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide
SMILESCC1=C(C(N)=O)C(c2ccc(O)cc2)NC(=O)N1c1ccc2[nH]ncc2c1
InChIInChI=1S/C19H17N5O3/c1-10-16(18(20)26)17(11-2-5-14(25)6-3-11)22-19(27)24(10)13-4-7-15-12(8-13)9-21-23-15/h2-9,17,25H,1H3,(H2,20,26)(H,21,23)(H,22,27)
InChIKeyMWMXTBNMSOITNP-UHFFFAOYSA-N
XLogP2.30
TPSA124.34 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 52.30
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide?
The IUPAC name of 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide (CID 69179636) is 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide.
What is the SMILES notation for 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide?
The canonical SMILES for 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide is CC1=C(C(N)=O)C(c2ccc(O)cc2)NC(=O)N1c1ccc2[nH]ncc2c1.
What is the InChIKey of 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide?
The InChIKey is MWMXTBNMSOITNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O3/c1-10-16(18(20)26)17(11-2-5-14(25)6-3-11)22-19(27)24(10)13-4-7-15-12(8-13)9-21-23-15/h2-9,17,25H,1H3,(H2,20,26)(H,21,23)(H,22,27).
What are the key properties of 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide?
6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide has a molecular weight of 363.38 g/mol, XLogP of 2.30, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxyphenyl)-3-(1H-indazol-5-yl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide is sourced from PubChem (CID 69179636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).