N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide

C20H19N7O — CID 46998627

IUPACN-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide
SMILESCn1nc(C2CC2)cc1NC(=O)Cn1nc(-c2cncnc2)c2ccccc21
InChIInChI=1S/C20H19N7O/c1-26-18(8-16(24-26)13-6-7-13)23-19(28)11-27-17-5-3-2-4-15(17)20(25-27)14-9-21-12-22-10-14/h2-5,8-10,12-13H,6-7,11H2,1H3,(H,23,28)
InChIKeyRMPFSPCQKUSCDQ-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.74
Rot. Bonds5

About N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide

N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide (PubChem CID 46998627) has the molecular formula C20H19N7O and a molecular weight of 373.42 g/mol. Its IUPAC name is N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide
PubChem CID46998627
Molecular FormulaC20H19N7O
Molecular Weight373.42 g/mol
Exact Mass373.17
IUPAC NameN-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide
SMILESCn1nc(C2CC2)cc1NC(=O)Cn1nc(-c2cncnc2)c2ccccc21
InChIInChI=1S/C20H19N7O/c1-26-18(8-16(24-26)13-6-7-13)23-19(28)11-27-17-5-3-2-4-15(17)20(25-27)14-9-21-12-22-10-14/h2-5,8-10,12-13H,6-7,11H2,1H3,(H,23,28)
InChIKeyRMPFSPCQKUSCDQ-UHFFFAOYSA-N
XLogP2.74
TPSA90.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

Afimetoran
CID 132271862
N-[1-[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]indol-6-yl]acetamide
CID 57384039
N-[3-[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-1H-indol-5-yl]acetamide
CID 136254272
N-{1-(4-Cyclopropyl-2-Fluorophenyl)-3-[1-(Propan-2-Yl)piperidin-4-Yl]-1h-Pyrazol-5-Yl}pyrazolo[1,5-A]pyrimidine-3-Carboxamide
CID 68357894
3-(1H-Indazol-5-yl)-N-propylimidazo(1,2-b)pyridazin-6-amine
CID 70679308
1-Tert-Butyl-3-[(1h-Indol-3-Yl)methyl]-1h-Pyrazolo[3,4-D]pyrimidin-4-Amine
CID 129316173
1,3-Dimethyl-7-[4-(2-methyl-imidazo[4,5-c]pyridin-1-yl)-phenyl]-4,6-dihydro-1H-pyrazolo[3,4-b][1,4]diazepin-5-one
CID 10068655
(2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 24785273
1-[3-(1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-6-yl]-3-[(1R)-1-phenylethyl]urea
CID 71555465
Trk Inhibitor C11
CID 90645511
Imidazo[1,2-a]pyrazin-8(5H)-one, 7-[(3,4-difluorophenyl)methyl]-6,7-dihydro-2-[5-methyl-2-[(1-methyl-1H-pyrazol-5-yl)amino]-4-pyrimidinyl]-
CID 129116809
(6S)-7-[(3,4-difluorophenyl)methyl]-6-methyl-2-[5-methyl-2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-5,6-dihydroimidazo[1,2-a]pyrazin-8-one
CID 129136448

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide?
The IUPAC name of N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide (CID 46998627) is N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide.
What is the SMILES notation for N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide?
The canonical SMILES for N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide is Cn1nc(C2CC2)cc1NC(=O)Cn1nc(-c2cncnc2)c2ccccc21.
What is the InChIKey of N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide?
The InChIKey is RMPFSPCQKUSCDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N7O/c1-26-18(8-16(24-26)13-6-7-13)23-19(28)11-27-17-5-3-2-4-15(17)20(25-27)14-9-21-12-22-10-14/h2-5,8-10,12-13H,6-7,11H2,1H3,(H,23,28).
What are the key properties of N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide?
N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide has a molecular weight of 373.42 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropyl-1-methylpyrazol-5-yl)-2-(3-pyrimidin-5-ylindazol-1-yl)acetamide is sourced from PubChem (CID 46998627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).