2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide

C19H25N5O2 — CID 78834668

IUPAC2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide
SMILESCCCN(CC(=O)Nc1ccccc1C)C(C)C(=O)Nc1ncccn1
InChIInChI=1S/C19H25N5O2/c1-4-12-24(13-17(25)22-16-9-6-5-8-14(16)2)15(3)18(26)23-19-20-10-7-11-21-19/h5-11,15H,4,12-13H2,1-3H3,(H,22,25)(H,20,21,23,26)
InChIKeyXWFRHOSCVUAQOG-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.46
Rot. Bonds8

About 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide

2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide (PubChem CID 78834668) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide.

Molecular Properties

Compound Name2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide
PubChem CID78834668
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Name2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide
SMILESCCCN(CC(=O)Nc1ccccc1C)C(C)C(=O)Nc1ncccn1
InChIInChI=1S/C19H25N5O2/c1-4-12-24(13-17(25)22-16-9-6-5-8-14(16)2)15(3)18(26)23-19-20-10-7-11-21-19/h5-11,15H,4,12-13H2,1-3H3,(H,22,25)(H,20,21,23,26)
InChIKeyXWFRHOSCVUAQOG-UHFFFAOYSA-N
XLogP2.46
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-chloro-2-pyridinyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]propanamide
CID 78817210
N-cyclopentyl-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]propanamide
CID 78789589
2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-[(2-methylphenyl)methyl]propanamide
CID 78840464
N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]propanamide
CID 78787959
2-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-(2-methylphenyl)propanamide
CID 51171051
2-[(2-amino-1,3-thiazol-5-yl)methyl-propylamino]-N-(2-methylphenyl)propanamide
CID 120904023
1-(2-methylphenyl)-3-pyrimidin-2-ylurea
CID 6477188
2-ethyl-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylbutanamide
CID 112790013
2-[[2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide
CID 9038968
2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-phenylacetamide
CID 9038815
2-(dibutylamino)-N-(2-methylphenyl)acetamide;hydrochloride
CID 3026049
N-(2-aminophenyl)-2-(dipropylamino)propanamide
CID 16778886

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide?
The IUPAC name of 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide (CID 78834668) is 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide.
What is the SMILES notation for 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide?
The canonical SMILES for 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide is CCCN(CC(=O)Nc1ccccc1C)C(C)C(=O)Nc1ncccn1.
What is the InChIKey of 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide?
The InChIKey is XWFRHOSCVUAQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-4-12-24(13-17(25)22-16-9-6-5-8-14(16)2)15(3)18(26)23-19-20-10-7-11-21-19/h5-11,15H,4,12-13H2,1-3H3,(H,22,25)(H,20,21,23,26).
What are the key properties of 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide?
2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide has a molecular weight of 355.44 g/mol, XLogP of 2.46, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-pyrimidin-2-ylpropanamide is sourced from PubChem (CID 78834668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).