4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide

C19H18N4O2 — CID 122302379

IUPAC4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2cnc(Oc3ccccc3)nc2)cc1
InChIInChI=1S/C19H18N4O2/c1-23(2)16-10-8-14(9-11-16)18(24)22-15-12-20-19(21-13-15)25-17-6-4-3-5-7-17/h3-13H,1-2H3,(H,22,24)
InChIKeyGCVAJVFNCLOINA-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.59
Rot. Bonds5

About 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide

4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide (PubChem CID 122302379) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide
PubChem CID122302379
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2cnc(Oc3ccccc3)nc2)cc1
InChIInChI=1S/C19H18N4O2/c1-23(2)16-10-8-14(9-11-16)18(24)22-15-12-20-19(21-13-15)25-17-6-4-3-5-7-17/h3-13H,1-2H3,(H,22,24)
InChIKeyGCVAJVFNCLOINA-UHFFFAOYSA-N
XLogP3.59
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-phenoxypyrimidin-5-yl)benzamide
CID 122302199
4-methylsulfanyl-N-(2-phenoxypyrimidin-5-yl)benzamide
CID 122302430
N-(2-phenoxypyrimidin-5-yl)naphthalene-2-carboxamide
CID 122302221
N-[6-(dimethylamino)-3-pyridinyl]-4-phenoxybenzamide
CID 30273384
3-methoxy-N-(2-phenoxypyrimidin-5-yl)benzamide
CID 122302206
3,4,5-trimethoxy-N-(2-phenoxypyrimidin-5-yl)benzamide
CID 122302212
1-(2-phenoxypyrimidin-5-yl)-3-phenylurea
CID 122302271
N-(2-phenoxypyrimidin-5-yl)quinoxaline-2-carboxamide
CID 122302374
2,2-dimethyl-N-(2-phenoxypyrimidin-5-yl)propanamide
CID 122302193
2,5-dimethyl-N-(2-phenoxypyrimidin-5-yl)benzamide
CID 122302232
N-(4-methylphenyl)-4-[5-(4-methylphenyl)pyrimidin-2-yl]oxybenzamide
CID 46388960
1-N-[4-(dimethylamino)phenyl]-4-N-(3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109050069

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide (CID 122302379) is 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide is CN(C)c1ccc(C(=O)Nc2cnc(Oc3ccccc3)nc2)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide?
The InChIKey is GCVAJVFNCLOINA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-23(2)16-10-8-14(9-11-16)18(24)22-15-12-20-19(21-13-15)25-17-6-4-3-5-7-17/h3-13H,1-2H3,(H,22,24).
What are the key properties of 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide?
4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide has a molecular weight of 334.38 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(2-phenoxypyrimidin-5-yl)benzamide is sourced from PubChem (CID 122302379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).