6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide

C18H19N5O2 — CID 112851453

IUPAC6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide
SMILESCCCNC(=O)c1cc(Nc2cc(C)on2)nc(-c2ccccc2)n1
InChIInChI=1S/C18H19N5O2/c1-3-9-19-18(24)14-11-15(21-16-10-12(2)25-23-16)22-17(20-14)13-7-5-4-6-8-13/h4-8,10-11H,3,9H2,1-2H3,(H,19,24)(H,20,21,22,23)
InChIKeyRUAQQMXSHAYIIT-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.32
Rot. Bonds6

About 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide

6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide (PubChem CID 112851453) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide
PubChem CID112851453
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC Name6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide
SMILESCCCNC(=O)c1cc(Nc2cc(C)on2)nc(-c2ccccc2)n1
InChIInChI=1S/C18H19N5O2/c1-3-9-19-18(24)14-11-15(21-16-10-12(2)25-23-16)22-17(20-14)13-7-5-4-6-8-13/h4-8,10-11H,3,9H2,1-2H3,(H,19,24)(H,20,21,22,23)
InChIKeyRUAQQMXSHAYIIT-UHFFFAOYSA-N
XLogP3.32
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyethyl)-6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenylpyrimidine-4-carboxamide
CID 112853283
6-anilino-2-phenyl-N-propylpyrimidine-4-carboxamide
CID 112851408
N,N-diethyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenylpyrimidine-4-carboxamide
CID 112854269
N-(3,4-dimethylphenyl)-6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenylpyrimidine-4-carboxamide
CID 112854465
N-ethyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N,2-diphenylpyrimidine-4-carboxamide
CID 112854472
6-(3-chloroanilino)-2-phenyl-N-propylpyrimidine-4-carboxamide
CID 112851418
2-phenyl-6-(2-propan-2-yloxyanilino)-N-propylpyrimidine-4-carboxamide
CID 112851428
6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-phenyl-N-propylpyrimidine-4-carboxamide
CID 112851443
6-(2,5-dimethoxyanilino)-2-phenyl-N-propylpyrimidine-4-carboxamide
CID 112851430
[6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenylpyrimidin-4-yl]-piperidin-1-ylmethanone
CID 112852983
6-[(4-methoxyphenyl)methylamino]-2-phenyl-N-propylpyrimidine-4-carboxamide
CID 112851378
N-butyl-6-(2-fluoroanilino)-2-phenylpyrimidine-4-carboxamide
CID 112852323

Frequently Asked Questions

What is the IUPAC name of 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide?
The IUPAC name of 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide (CID 112851453) is 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide.
What is the SMILES notation for 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide?
The canonical SMILES for 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide is CCCNC(=O)c1cc(Nc2cc(C)on2)nc(-c2ccccc2)n1.
What is the InChIKey of 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide?
The InChIKey is RUAQQMXSHAYIIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c1-3-9-19-18(24)14-11-15(21-16-10-12(2)25-23-16)22-17(20-14)13-7-5-4-6-8-13/h4-8,10-11H,3,9H2,1-2H3,(H,19,24)(H,20,21,22,23).
What are the key properties of 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide?
6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 3.32, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-phenyl-N-propylpyrimidine-4-carboxamide is sourced from PubChem (CID 112851453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).