6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide

C10H11N5O2 — CID 129308158

IUPAC6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1.Nc1ccnc(=O)[nH]1
InChIInChI=1S/C6H6N2O.C4H5N3O/c7-6(9)5-2-1-3-8-4-5;5-3-1-2-6-4(8)7-3/h1-4H,(H2,7,9);1-2H,(H3,5,6,7,8)
InChIKeyQQAKOGZYSUCKHD-UHFFFAOYSA-N
MW233.23 g/mol
LogP-0.47
Rot. Bonds1

About 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide

6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide (PubChem CID 129308158) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide
PubChem CID129308158
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC Name6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1.Nc1ccnc(=O)[nH]1
InChIInChI=1S/C6H6N2O.C4H5N3O/c7-6(9)5-2-1-3-8-4-5;5-3-1-2-6-4(8)7-3/h1-4H,(H2,7,9);1-2H,(H3,5,6,7,8)
InChIKeyQQAKOGZYSUCKHD-UHFFFAOYSA-N
XLogP-0.47
TPSA127.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 5-0.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 67723788
CID 175154223
CID 175154223
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CID 70159642
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CID 159465776
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Frequently Asked Questions

What is the IUPAC name of 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide?
The IUPAC name of 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide (CID 129308158) is 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide?
The canonical SMILES for 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide is NC(=O)c1cccnc1.Nc1ccnc(=O)[nH]1.
What is the InChIKey of 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide?
The InChIKey is QQAKOGZYSUCKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2O.C4H5N3O/c7-6(9)5-2-1-3-8-4-5;5-3-1-2-6-4(8)7-3/h1-4H,(H2,7,9);1-2H,(H3,5,6,7,8).
What are the key properties of 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide?
6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide has a molecular weight of 233.23 g/mol, XLogP of -0.47, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1H-pyrimidin-2-one;pyridine-3-carboxamide is sourced from PubChem (CID 129308158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).