2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide

C16H20N4O — CID 60848234

IUPAC2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide
SMILESCCCC(C)(N)C(=O)Nc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C16H20N4O/c1-3-9-16(2,17)15(21)20-13-10-18-14(19-11-13)12-7-5-4-6-8-12/h4-8,10-11H,3,9,17H2,1-2H3,(H,20,21)
InChIKeySTOHXQIJKNEWIM-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.60
Rot. Bonds5

About 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide

2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide (PubChem CID 60848234) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide
PubChem CID60848234
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide
SMILESCCCC(C)(N)C(=O)Nc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C16H20N4O/c1-3-9-16(2,17)15(21)20-13-10-18-14(19-11-13)12-7-5-4-6-8-12/h4-8,10-11H,3,9,17H2,1-2H3,(H,20,21)
InChIKeySTOHXQIJKNEWIM-UHFFFAOYSA-N
XLogP2.60
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-methyl-N-quinolin-3-ylpentanamide
CID 60846674
2-amino-2-methyl-N-(6-phenoxy-3-pyridinyl)pentanamide
CID 119849182
4-[(2-amino-2-methylpentanoyl)amino]benzoic acid
CID 61156660
N-(2-phenylpyrimidin-5-yl)propanamide
CID 53014772
2-amino-2-methyl-N-phenylhexanamide
CID 170712188
2-amino-2-methyl-N-(6-methylsulfonyl-3-pyridinyl)pentanamide
CID 54928443
2-amino-N-(5-benzyl-1,3-thiazol-2-yl)-2-methylpentanamide
CID 119687594
2,2-dimethyl-N-[2-oxo-2-[(2-phenylpyrimidin-5-yl)amino]ethyl]propanamide
CID 134009428
2-amino-N-(2-phenylpyrimidin-5-yl)pentanamide
CID 43709270
2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide
CID 60854044
N-[5-[(2-amino-2-methylpentanoyl)amino]-2-pyridinyl]cyclopropanecarboxamide
CID 119879412
2-amino-2-methyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)pentanamide
CID 60848949

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide?
The IUPAC name of 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide (CID 60848234) is 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide?
The canonical SMILES for 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide is CCCC(C)(N)C(=O)Nc1cnc(-c2ccccc2)nc1.
What is the InChIKey of 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide?
The InChIKey is STOHXQIJKNEWIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-3-9-16(2,17)15(21)20-13-10-18-14(19-11-13)12-7-5-4-6-8-12/h4-8,10-11H,3,9,17H2,1-2H3,(H,20,21).
What are the key properties of 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide?
2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide has a molecular weight of 284.36 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide is sourced from PubChem (CID 60848234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).