2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

C18H19N7O2 — CID 70925570

IUPAC2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCCNC(=O)c1c(N)[nH]n2c(=O)cc(-c3ccc4n[nH]c(C)c4c3)nc12
InChIInChI=1S/C18H19N7O2/c1-3-6-20-18(27)15-16(19)24-25-14(26)8-13(21-17(15)25)10-4-5-12-11(7-10)9(2)22-23-12/h4-5,7-8,24H,3,6,19H2,1-2H3,(H,20,27)(H,22,23)
InChIKeyNIWUPTIVLCJGCY-UHFFFAOYSA-N
MW365.40 g/mol
LogP1.60
Rot. Bonds4

About 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 70925570) has the molecular formula C18H19N7O2 and a molecular weight of 365.40 g/mol. Its IUPAC name is 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID70925570
Molecular FormulaC18H19N7O2
Molecular Weight365.40 g/mol
Exact Mass365.16
IUPAC Name2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCCNC(=O)c1c(N)[nH]n2c(=O)cc(-c3ccc4n[nH]c(C)c4c3)nc12
InChIInChI=1S/C18H19N7O2/c1-3-6-20-18(27)15-16(19)24-25-14(26)8-13(21-17(15)25)10-4-5-12-11(7-10)9(2)22-23-12/h4-5,7-8,24H,3,6,19H2,1-2H3,(H,20,27)(H,22,23)
InChIKeyNIWUPTIVLCJGCY-UHFFFAOYSA-N
XLogP1.60
TPSA133.96 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.40
LogP ≤ 51.60
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 70925570) is 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is CCCNC(=O)c1c(N)[nH]n2c(=O)cc(-c3ccc4n[nH]c(C)c4c3)nc12.
What is the InChIKey of 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is NIWUPTIVLCJGCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7O2/c1-3-6-20-18(27)15-16(19)24-25-14(26)8-13(21-17(15)25)10-4-5-12-11(7-10)9(2)22-23-12/h4-5,7-8,24H,3,6,19H2,1-2H3,(H,20,27)(H,22,23).
What are the key properties of 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 365.40 g/mol, XLogP of 1.60, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(3-methyl-2H-indazol-5-yl)-7-oxo-N-propyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 70925570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).