N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide

C15H15N5O2 — CID 167992530

IUPACN-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide
SMILESCc1nc[nH]c(=O)c1CCC(=O)Nc1n[nH]c2ccccc12
InChIInChI=1S/C15H15N5O2/c1-9-10(15(22)17-8-16-9)6-7-13(21)18-14-11-4-2-3-5-12(11)19-20-14/h2-5,8H,6-7H2,1H3,(H,16,17,22)(H2,18,19,20,21)
InChIKeyZKOFEBFBCCQNKN-UHFFFAOYSA-N
MW297.32 g/mol
LogP1.53
Rot. Bonds4

About N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide

N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide (PubChem CID 167992530) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide.

Molecular Properties

Compound NameN-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide
PubChem CID167992530
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC NameN-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide
SMILESCc1nc[nH]c(=O)c1CCC(=O)Nc1n[nH]c2ccccc12
InChIInChI=1S/C15H15N5O2/c1-9-10(15(22)17-8-16-9)6-7-13(21)18-14-11-4-2-3-5-12(11)19-20-14/h2-5,8H,6-7H2,1H3,(H,16,17,22)(H2,18,19,20,21)
InChIKeyZKOFEBFBCCQNKN-UHFFFAOYSA-N
XLogP1.53
TPSA103.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-indazol-3-yl)-3-methylsulfanylpropanamide
CID 60735515
4-[3-(1H-indazol-3-ylamino)-3-oxopropyl]benzoic acid
CID 154781594
3-(2-amino-2-oxoethyl)sulfanyl-N-(1H-indazol-3-yl)propanamide
CID 60735680
ethyl 3-(1H-indazol-3-ylamino)-3-oxopropanoate
CID 110474185
2-amino-N-(1H-indazol-3-yl)acetamide;hydrochloride
CID 130729532
N-(1H-indazol-3-yl)-3,4-dimethyl-6-oxo-1H-pyridazine-5-carboxamide
CID 61068182
3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide
CID 135933507
N-(1H-indazol-3-yl)-2-(3-methylphenyl)acetamide
CID 62686567
2-tert-butylsulfanyl-N-(1H-indazol-3-yl)acetamide
CID 60735552
1-ethyl-3-(1H-indazol-3-yl)urea
CID 62687117
2-(3,5-dimethylpyrazol-1-yl)-N-(1H-indazol-3-yl)acetamide
CID 60735352
2-cyclopentyl-N-(1H-indazol-3-yl)acetamide
CID 55023308

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide?
The IUPAC name of N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide (CID 167992530) is N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide.
What is the SMILES notation for N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide?
The canonical SMILES for N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide is Cc1nc[nH]c(=O)c1CCC(=O)Nc1n[nH]c2ccccc12.
What is the InChIKey of N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide?
The InChIKey is ZKOFEBFBCCQNKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c1-9-10(15(22)17-8-16-9)6-7-13(21)18-14-11-4-2-3-5-12(11)19-20-14/h2-5,8H,6-7H2,1H3,(H,16,17,22)(H2,18,19,20,21).
What are the key properties of N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide?
N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide has a molecular weight of 297.32 g/mol, XLogP of 1.53, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-3-yl)-3-(4-methyl-6-oxo-1H-pyrimidin-5-yl)propanamide is sourced from PubChem (CID 167992530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).