N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide

C16H19N3O2 — CID 99842142

IUPACN-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide
SMILESCc1ccnc(NC(=O)Cc2cccc(OC(C)C)c2)n1
InChIInChI=1S/C16H19N3O2/c1-11(2)21-14-6-4-5-13(9-14)10-15(20)19-16-17-8-7-12(3)18-16/h4-9,11H,10H2,1-3H3,(H,17,18,19,20)
InChIKeyIGPGKHMNKKCOTE-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.75
Rot. Bonds5

About N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide

N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide (PubChem CID 99842142) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide
PubChem CID99842142
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide
SMILESCc1ccnc(NC(=O)Cc2cccc(OC(C)C)c2)n1
InChIInChI=1S/C16H19N3O2/c1-11(2)21-14-6-4-5-13(9-14)10-15(20)19-16-17-8-7-12(3)18-16/h4-9,11H,10H2,1-3H3,(H,17,18,19,20)
InChIKeyIGPGKHMNKKCOTE-UHFFFAOYSA-N
XLogP2.75
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,2-oxazol-3-yl)-2-(3-propan-2-yloxyphenyl)acetamide
CID 75399150
2-[(4-methylpyrimidin-2-yl)amino]-1-(3-propan-2-yloxyphenyl)ethanol
CID 133304652
(2R)-2-[[2-(3-propan-2-yloxyphenyl)acetyl]amino]propanoic acid
CID 119244137
N-(2-methyl-4-pyridinyl)-2-(4-propan-2-yloxyphenyl)acetamide
CID 110768807
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide;hydrochloride
CID 119606176
2-methyl-4-[[2-(3-propan-2-yloxyphenyl)acetyl]amino]benzoic acid
CID 119240314
formic acid;2-(3-methoxyphenyl)-N-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide
CID 155972799
2-(3-propan-2-yloxyphenyl)acetyl chloride
CID 18333440
2-phenyl-N-(3-propan-2-yloxyphenyl)acetamide
CID 6458056
N-(2-amino-2-methylpropyl)-2-(3-propan-2-yloxyphenyl)acetamide;hydrochloride
CID 119626689
N-(3-aminopropyl)-2-(3-propan-2-yloxyphenyl)acetamide;hydrochloride
CID 119405627
3-[4-[[2-(3-propan-2-yloxyphenyl)acetyl]amino]phenyl]propanoic acid
CID 119252327

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide?
The IUPAC name of N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide (CID 99842142) is N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide is Cc1ccnc(NC(=O)Cc2cccc(OC(C)C)c2)n1.
What is the InChIKey of N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide?
The InChIKey is IGPGKHMNKKCOTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11(2)21-14-6-4-5-13(9-14)10-15(20)19-16-17-8-7-12(3)18-16/h4-9,11H,10H2,1-3H3,(H,17,18,19,20).
What are the key properties of N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide?
N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpyrimidin-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 99842142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).