N-(5-phenylpyrimidin-2-yl)benzamide

C17H13N3O — CID 71415986

IUPACN-(5-phenylpyrimidin-2-yl)benzamide
SMILESO=C(Nc1ncc(-c2ccccc2)cn1)c1ccccc1
InChIInChI=1S/C17H13N3O/c21-16(14-9-5-2-6-10-14)20-17-18-11-15(12-19-17)13-7-3-1-4-8-13/h1-12H,(H,18,19,20,21)
InChIKeyDYEOOWQTZWZLFZ-UHFFFAOYSA-N
MW275.31 g/mol
LogP3.40
Rot. Bonds3

About N-(5-phenylpyrimidin-2-yl)benzamide

N-(5-phenylpyrimidin-2-yl)benzamide (PubChem CID 71415986) has the molecular formula C17H13N3O and a molecular weight of 275.31 g/mol. Its IUPAC name is N-(5-phenylpyrimidin-2-yl)benzamide.

Molecular Properties

Compound NameN-(5-phenylpyrimidin-2-yl)benzamide
PubChem CID71415986
Molecular FormulaC17H13N3O
Molecular Weight275.31 g/mol
Exact Mass275.11
IUPAC NameN-(5-phenylpyrimidin-2-yl)benzamide
SMILESO=C(Nc1ncc(-c2ccccc2)cn1)c1ccccc1
InChIInChI=1S/C17H13N3O/c21-16(14-9-5-2-6-10-14)20-17-18-11-15(12-19-17)13-7-3-1-4-8-13/h1-12H,(H,18,19,20,21)
InChIKeyDYEOOWQTZWZLFZ-UHFFFAOYSA-N
XLogP3.40
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-pyrimidin-2-ylbenzamide
CID 638481
N-pyrimidin-2-ylbenzamide;silver
CID 175574792
5-phenyl-N-pyrimidin-2-ylpyridine-2-carboxamide
CID 110683610
3-amino-N-(5-phenylpyrimidin-2-yl)-4-(trifluoromethoxy)benzamide
CID 118385340
(E)-but-2-enedioic acid;N-pyrimidin-2-ylbenzamide
CID 162326925
N-[4-(4-phenylphenyl)phenyl]benzamide
CID 59742294
2-[(5-phenylpyrimidin-2-yl)amino]acetic acid
CID 116975092
N-(5,6-diphenyl-1,2,4-triazin-3-yl)benzamide
CID 23910989
3-[(2-chloroacetyl)amino]-N-(5-phenylpyrimidin-2-yl)-4-(trifluoromethoxy)benzamide
CID 118385290
N-(5-phenyl-1,2,4-oxadiazol-3-yl)benzamide
CID 15643333
N-benzyl-4-[2-(benzylamino)pyrimidin-5-yl]benzamide
CID 53108687
5-phenyl-N-(1-phenylethylideneamino)pyrimidin-2-amine
CID 4714117

Frequently Asked Questions

What is the IUPAC name of N-(5-phenylpyrimidin-2-yl)benzamide?
The IUPAC name of N-(5-phenylpyrimidin-2-yl)benzamide (CID 71415986) is N-(5-phenylpyrimidin-2-yl)benzamide.
What is the SMILES notation for N-(5-phenylpyrimidin-2-yl)benzamide?
The canonical SMILES for N-(5-phenylpyrimidin-2-yl)benzamide is O=C(Nc1ncc(-c2ccccc2)cn1)c1ccccc1.
What is the InChIKey of N-(5-phenylpyrimidin-2-yl)benzamide?
The InChIKey is DYEOOWQTZWZLFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O/c21-16(14-9-5-2-6-10-14)20-17-18-11-15(12-19-17)13-7-3-1-4-8-13/h1-12H,(H,18,19,20,21).
What are the key properties of N-(5-phenylpyrimidin-2-yl)benzamide?
N-(5-phenylpyrimidin-2-yl)benzamide has a molecular weight of 275.31 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-phenylpyrimidin-2-yl)benzamide is sourced from PubChem (CID 71415986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).