2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile

C7H5N5O — CID 146257072

IUPAC2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile
SMILESN#Cc1c(N)nn2c1CC(=O)N=C2
InChIInChI=1S/C7H5N5O/c8-2-4-5-1-6(13)10-3-12(5)11-7(4)9/h3H,1H2,(H2,9,11)
InChIKeyNPNCOIVGMIXBAK-UHFFFAOYSA-N
MW175.15 g/mol
LogP-0.70
Rot. Bonds

About 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile

2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile (PubChem CID 146257072) has the molecular formula C7H5N5O and a molecular weight of 175.15 g/mol. Its IUPAC name is 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile
PubChem CID146257072
Molecular FormulaC7H5N5O
Molecular Weight175.15 g/mol
Exact Mass175.05
IUPAC Name2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile
SMILESN#Cc1c(N)nn2c1CC(=O)N=C2
InChIInChI=1S/C7H5N5O/c8-2-4-5-1-6(13)10-3-12(5)11-7(4)9/h3H,1H2,(H2,9,11)
InChIKeyNPNCOIVGMIXBAK-UHFFFAOYSA-N
XLogP-0.70
TPSA97.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.15
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 102825781
3-amino-1-methylpyrazole-4,5-dicarbonitrile
CID 5231924
2-amino-3,4-dioxocyclobutene-1-carbonitrile
CID 142659151
2-amino-5-(3-hydroxypyrrolidin-1-yl)-4,5-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 139455164
4-amino-6-piperidin-1-ylpyrimidine-5-carbonitrile
CID 90436574
4,6-diamino-2-oxo-1-phenyl-3H-pyrrolo[2,3-b]pyridine-5-carbonitrile
CID 2325122
1,4-diamino-6-chloro-9,10-dioxoanthracene-2,3-dicarbonitrile
CID 159694004
3-amino-5-(4-bromo-2,6-difluorophenyl)-1-cyclopentylpyrazole-4-carbonitrile
CID 129248437
5-amino-3-benzoyl-1-(4-chlorophenyl)pyrazole-4-carbonitrile
CID 14362916
3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile
CID 10108095
4-amino-6-[(1S)-1-iodoethyl]pyrimidine-5-carbonitrile
CID 129081940

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile?
The IUPAC name of 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile (CID 146257072) is 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile.
What is the SMILES notation for 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile?
The canonical SMILES for 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile is N#Cc1c(N)nn2c1CC(=O)N=C2.
What is the InChIKey of 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile?
The InChIKey is NPNCOIVGMIXBAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N5O/c8-2-4-5-1-6(13)10-3-12(5)11-7(4)9/h3H,1H2,(H2,9,11).
What are the key properties of 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile?
2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile has a molecular weight of 175.15 g/mol, XLogP of -0.70, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-oxo-4H-pyrazolo[1,5-c]pyrimidine-3-carbonitrile is sourced from PubChem (CID 146257072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).