N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea

C154H169N43O14 — CID 158136889

About N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea

N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea (PubChem CID 158136889) has the molecular formula C154H169N43O14 and a molecular weight of 2846.33 g/mol. Its IUPAC name is N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea.

Molecular Properties

• Compound Name: N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea
• PubChem CID: 158136889
• Molecular Formula: C154H169N43O14
• Molecular Weight: 2846.33 g/mol
• Exact Mass: 2844.38
• IUPAC Name: N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea
• SMILES: CC(=O)NCCCNc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.CCC(=O)CNc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.CCCCCCNc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.CNCCCNc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.CONc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.Cc1cc(NCC(=O)N(C)C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.Cc1cc(NCCO)nc(NC(=O)Nc2ccc3ccccc3c2)n1.Cc1cc(NO)nc(NC(=O)Nc2ccc3ccccc3c2)n1
• InChI: InChI=1S/C22H27N5O.C21H24N6O2.C20H22N6O2.C20H24N6O.C20H21N5O2.C18H19N5O2.C17H17N5O2.C16H15N5O2/c1-3-4-5-8-13-23-20-14-16(2)24-21(26-20)27-22(28)25-19-12-11-17-9-6-7-10-18(17)15-19;1-14-12-19(23-11-5-10-22-15(2)28)26-20(24-14)27-21(29)25-18-9-8-16-6-3-4-7-17(16)13-18;1-13-10-17(21-12-18(27)26(2)3)24-19(22-13)25-20(28)23-16-9-8-14-6-4-5-7-15(14)11-16;1-14-12-18(22-11-5-10-21-2)25-19(23-14)26-20(27)24-17-9-8-15-6-3-4-7-16(15)13-17;1-3-17(26)12-21-18-10-13(2)22-19(24-18)25-20(27)23-16-9-8-14-6-4-5-7-15(14)11-16;1-12-10-16(19-8-9-24)22-17(20-12)23-18(25)21-15-7-6-13-4-2-3-5-14(13)11-15;1-11-9-15(22-24-2)20-16(18-11)21-17(23)19-14-8-7-12-5-3-4-6-13(12)10-14;1-10-8-14(21-23)19-15(17-10)20-16(22)18-13-7-6-11-4-2-3-5-12(11)9-13/h6-7,9-12,14-15H,3-5,8,13H2,1-2H3,(H3,23,24,25,26,27,28);3-4,6-9,12-13H,5,10-11H2,1-2H3,(H,22,28)(H3,23,24,25,26,27,29);4-11H,12H2,1-3H3,(H3,21,22,23,24,25,28);3-4,6-9,12-13,21H,5,10-11H2,1-2H3,(H3,22,23,24,25,26,27);4-11H,3,12H2,1-2H3,(H3,21,22,23,24,25,27);2-7,10-11,24H,8-9H2,1H3,(H3,19,20,21,22,23,25);3-10H,1-2H3,(H3,18,19,20,21,22,23);2-9,23H,1H3,(H3,17,18,19,20,21,22)
• InChIKey: FTLKDDKQHRLINF-UHFFFAOYSA-N
• XLogP: 29.68
• TPSA: 759.72 Ų
• H-Bond Donors: 28
• H-Bond Acceptors: 39
• Rotatable Bonds: 45
• Heavy Atoms: 211
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2846.33
LogP ≤ 5	29.68
H-Bond Donors ≤ 5	28
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea?

The IUPAC name of N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea (CID 158136889) is N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea.

What is the SMILES notation for N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea?

The canonical SMILES for N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea is CC(=O)NCCCNc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.CCC(=O)CNc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.CCCCCCNc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.CNCCCNc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.CONc1cc(C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.Cc1cc(NCC(=O)N(C)C)nc(NC(=O)Nc2ccc3ccccc3c2)n1.Cc1cc(NCCO)nc(NC(=O)Nc2ccc3ccccc3c2)n1.Cc1cc(NO)nc(NC(=O)Nc2ccc3ccccc3c2)n1.

What is the InChIKey of N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea?

The InChIKey is FTLKDDKQHRLINF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N5O.C21H24N6O2.C20H22N6O2.C20H24N6O.C20H21N5O2.C18H19N5O2.C17H17N5O2.C16H15N5O2/c1-3-4-5-8-13-23-20-14-16(2)24-21(26-20)27-22(28)25-19-12-11-17-9-6-7-10-18(17)15-19;1-14-12-19(23-11-5-10-22-15(2)28)26-20(24-14)27-21(29)25-18-9-8-16-6-3-4-7-17(16)13-18;1-13-10-17(21-12-18(27)26(2)3)24-19(22-13)25-20(28)23-16-9-8-14-6-4-5-7-15(14)11-16;1-14-12-18(22-11-5-10-21-2)25-19(23-14)26-20(27)24-17-9-8-15-6-3-4-7-16(15)13-17;1-3-17(26)12-21-18-10-13(2)22-19(24-18)25-20(27)23-16-9-8-14-6-4-5-7-15(14)11-16;1-12-10-16(19-8-9-24)22-17(20-12)23-18(25)21-15-7-6-13-4-2-3-5-14(13)11-15;1-11-9-15(22-24-2)20-16(18-11)21-17(23)19-14-8-7-12-5-3-4-6-13(12)10-14;1-10-8-14(21-23)19-15(17-10)20-16(22)18-13-7-6-11-4-2-3-5-12(11)9-13/h6-7,9-12,14-15H,3-5,8,13H2,1-2H3,(H3,23,24,25,26,27,28);3-4,6-9,12-13H,5,10-11H2,1-2H3,(H,22,28)(H3,23,24,25,26,27,29);4-11H,12H2,1-3H3,(H3,21,22,23,24,25,28);3-4,6-9,12-13,21H,5,10-11H2,1-2H3,(H3,22,23,24,25,26,27);4-11H,3,12H2,1-2H3,(H3,21,22,23,24,25,27);2-7,10-11,24H,8-9H2,1H3,(H3,19,20,21,22,23,25);3-10H,1-2H3,(H3,18,19,20,21,22,23);2-9,23H,1H3,(H3,17,18,19,20,21,22).

What are the key properties of N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea?

N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea has a molecular weight of 2846.33 g/mol, XLogP of 29.68, 45 rotatable bonds, 28 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-dimethyl-2-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]acetamide;1-[4-(hexylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(hydroxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(2-hydroxyethylamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-(methoxyamino)-6-methylpyrimidin-2-yl]-3-naphthalen-2-ylurea;1-[4-methyl-6-[3-(methylamino)propylamino]pyrimidin-2-yl]-3-naphthalen-2-ylurea;N-[3-[[6-methyl-2-(naphthalen-2-ylcarbamoylamino)pyrimidin-4-yl]amino]propyl]acetamide;1-[4-methyl-6-(2-oxobutylamino)pyrimidin-2-yl]-3-naphthalen-2-ylurea is sourced from PubChem (CID 158136889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).