3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide

C15H15N5O3 — CID 54260593

IUPAC3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide
SMILESNc1n[nH]c2c1C(=O)c1c(C(=O)NN3CCOCC3)cccc1-2
InChIInChI=1S/C15H15N5O3/c16-14-11-12(17-18-14)8-2-1-3-9(10(8)13(11)21)15(22)19-20-4-6-23-7-5-20/h1-3H,4-7H2,(H,19,22)(H3,16,17,18)
InChIKeyRDFMXPOCFAKZIJ-UHFFFAOYSA-N
MW313.32 g/mol
LogP0.18
Rot. Bonds2

About 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide

3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide (PubChem CID 54260593) has the molecular formula C15H15N5O3 and a molecular weight of 313.32 g/mol. Its IUPAC name is 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide
PubChem CID54260593
Molecular FormulaC15H15N5O3
Molecular Weight313.32 g/mol
Exact Mass313.12
IUPAC Name3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide
SMILESNc1n[nH]c2c1C(=O)c1c(C(=O)NN3CCOCC3)cccc1-2
InChIInChI=1S/C15H15N5O3/c16-14-11-12(17-18-14)8-2-1-3-9(10(8)13(11)21)15(22)19-20-4-6-23-7-5-20/h1-3H,4-7H2,(H,19,22)(H3,16,17,18)
InChIKeyRDFMXPOCFAKZIJ-UHFFFAOYSA-N
XLogP0.18
TPSA113.34 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.32
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide?
The IUPAC name of 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide (CID 54260593) is 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide is Nc1n[nH]c2c1C(=O)c1c(C(=O)NN3CCOCC3)cccc1-2.
What is the InChIKey of 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide?
The InChIKey is RDFMXPOCFAKZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O3/c16-14-11-12(17-18-14)8-2-1-3-9(10(8)13(11)21)15(22)19-20-4-6-23-7-5-20/h1-3H,4-7H2,(H,19,22)(H3,16,17,18).
What are the key properties of 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide?
3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide has a molecular weight of 313.32 g/mol, XLogP of 0.18, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-morpholin-4-yl-4-oxo-1H-indeno[2,1-d]pyrazole-5-carboxamide is sourced from PubChem (CID 54260593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).