2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide

C15H20N4O2 — CID 91890167

IUPAC2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide
SMILESCCCNC(=O)Cn1ccn2nc3c(c2c1=O)CCCC3
InChIInChI=1S/C15H20N4O2/c1-2-7-16-13(20)10-18-8-9-19-14(15(18)21)11-5-3-4-6-12(11)17-19/h8-9H,2-7,10H2,1H3,(H,16,20)
InChIKeyZHYFRUDUSQKGME-UHFFFAOYSA-N
MW288.35 g/mol
LogP0.90
Rot. Bonds4

About 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide

2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide (PubChem CID 91890167) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide.

Molecular Properties

Compound Name2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide
PubChem CID91890167
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide
SMILESCCCNC(=O)Cn1ccn2nc3c(c2c1=O)CCCC3
InChIInChI=1S/C15H20N4O2/c1-2-7-16-13(20)10-18-8-9-19-14(15(18)21)11-5-3-4-6-12(11)17-19/h8-9H,2-7,10H2,1H3,(H,16,20)
InChIKeyZHYFRUDUSQKGME-UHFFFAOYSA-N
XLogP0.90
TPSA68.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-[2-(Diethylamino)ethyl-methylamino]-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-ylmethanone
CID 45488805
5-(cyclohexylmethylamino)-N,1-dimethyl-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 45160022
1-(cyclohexylmethyl)-5-(cyclopentylamino)-N-methyl-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 45160773
(S)-N-(2,6-Dioxopiperidin-3-yl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 150391238
1H,2H,7H,8H,9H,10H-pyrazino[1,2-b]indazol-1-one
CID 16956491
2-(1-(tert-butyl)-4-isopropyl-7-oxo-1H-pyrazolo[3,4-d]pyridazin-6(7H)-yl)-N-methylacetamide
CID 44037111
N-cyclopentyl-2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)acetamide
CID 46395087
2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)-N-propan-2-ylacetamide
CID 46395094
N-cyclopropyl-2-(1-ethyl-3-methyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)acetamide
CID 46395097
N-cyclohexyl-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)acetamide
CID 46395180
N-cyclohexyl-N-methyl-2-{1-oxo-1H,2H,7H,8H,9H,10H-pyrazino[1,2-b]indazol-2-yl}acetamide
CID 91890131
N-[(4-Fluorophenyl)methyl]-2-{1-oxo-1H,2H,7H,8H,9H,10H-pyrazino[1,2-B]indazol-2-YL}acetamide
CID 91890147

Frequently Asked Questions

What is the IUPAC name of 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide?
The IUPAC name of 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide (CID 91890167) is 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide.
What is the SMILES notation for 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide?
The canonical SMILES for 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide is CCCNC(=O)Cn1ccn2nc3c(c2c1=O)CCCC3.
What is the InChIKey of 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide?
The InChIKey is ZHYFRUDUSQKGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-2-7-16-13(20)10-18-8-9-19-14(15(18)21)11-5-3-4-6-12(11)17-19/h8-9H,2-7,10H2,1H3,(H,16,20).
What are the key properties of 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide?
2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide has a molecular weight of 288.35 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-oxo-7,8,9,10-tetrahydropyrazino[1,2-b]indazol-2-yl)-N-propylacetamide is sourced from PubChem (CID 91890167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).