N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide

C11H12N4O — CID 173153156

IUPACN-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide
SMILESNC1=CNC(NC(=O)c2ccccc2)N=C1
InChIInChI=1S/C11H12N4O/c12-9-6-13-11(14-7-9)15-10(16)8-4-2-1-3-5-8/h1-7,11,13H,12H2,(H,15,16)
InChIKeyVHPPQHUKZWYWGQ-UHFFFAOYSA-N
MW216.24 g/mol
LogP0.17
Rot. Bonds2

About N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide

N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide (PubChem CID 173153156) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide.

Molecular Properties

Compound NameN-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide
PubChem CID173153156
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC NameN-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide
SMILESNC1=CNC(NC(=O)c2ccccc2)N=C1
InChIInChI=1S/C11H12N4O/c12-9-6-13-11(14-7-9)15-10(16)8-4-2-1-3-5-8/h1-7,11,13H,12H2,(H,15,16)
InChIKeyVHPPQHUKZWYWGQ-UHFFFAOYSA-N
XLogP0.17
TPSA79.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide?
The IUPAC name of N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide (CID 173153156) is N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide.
What is the SMILES notation for N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide?
The canonical SMILES for N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide is NC1=CNC(NC(=O)c2ccccc2)N=C1.
What is the InChIKey of N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide?
The InChIKey is VHPPQHUKZWYWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c12-9-6-13-11(14-7-9)15-10(16)8-4-2-1-3-5-8/h1-7,11,13H,12H2,(H,15,16).
What are the key properties of N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide?
N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide has a molecular weight of 216.24 g/mol, XLogP of 0.17, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-1,2-dihydropyrimidin-2-yl)benzamide is sourced from PubChem (CID 173153156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).