2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide

C14H15N5O2 — CID 154851326

IUPAC2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide
SMILESO=C(Nc1cn[nH]c1C1CC1)c1cc(=O)[nH]c(C2CC2)n1
InChIInChI=1S/C14H15N5O2/c20-11-5-9(16-13(18-11)8-3-4-8)14(21)17-10-6-15-19-12(10)7-1-2-7/h5-8H,1-4H2,(H,15,19)(H,17,21)(H,16,18,20)
InChIKeyLCCBBXKCZSRFDZ-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.50
Rot. Bonds4

About 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide

2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide (PubChem CID 154851326) has the molecular formula C14H15N5O2 and a molecular weight of 285.31 g/mol. Its IUPAC name is 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide
PubChem CID154851326
Molecular FormulaC14H15N5O2
Molecular Weight285.31 g/mol
Exact Mass285.12
IUPAC Name2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide
SMILESO=C(Nc1cn[nH]c1C1CC1)c1cc(=O)[nH]c(C2CC2)n1
InChIInChI=1S/C14H15N5O2/c20-11-5-9(16-13(18-11)8-3-4-8)14(21)17-10-6-15-19-12(10)7-1-2-7/h5-8H,1-4H2,(H,15,19)(H,17,21)(H,16,18,20)
InChIKeyLCCBBXKCZSRFDZ-UHFFFAOYSA-N
XLogP1.50
TPSA103.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide?
The IUPAC name of 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide (CID 154851326) is 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide is O=C(Nc1cn[nH]c1C1CC1)c1cc(=O)[nH]c(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide?
The InChIKey is LCCBBXKCZSRFDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2/c20-11-5-9(16-13(18-11)8-3-4-8)14(21)17-10-6-15-19-12(10)7-1-2-7/h5-8H,1-4H2,(H,15,19)(H,17,21)(H,16,18,20).
What are the key properties of 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide?
2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide has a molecular weight of 285.31 g/mol, XLogP of 1.50, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-4-yl)-6-oxo-1H-pyrimidine-4-carboxamide is sourced from PubChem (CID 154851326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).