N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine

C84H121N32O+ — CID 159798378

About N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine

N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine (PubChem CID 159798378) has the molecular formula C84H121N32O+ and a molecular weight of 1595.11 g/mol. Its IUPAC name is N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine.

Molecular Properties

• Compound Name: N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine
• PubChem CID: 159798378
• Molecular Formula: C84H121N32O+
• Molecular Weight: 1595.11 g/mol
• Exact Mass: 1594.04
• IUPAC Name: N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine
• SMILES: CCCN(C)Cc1cn[nH]c1-c1cnn(-c2ccccc2)c1.CCCN(C)Cc1cn[nH]c1-c1cnn(CC)c1.CCCN(C)Cc1cn[nH]c1-c1cnn(CCO)c1.CCCN(C)Cc1cn[nH]c1C1=CCN=[N+]1C.CN(CCN)Cc1cn[nH]c1-c1ccc2ccn(C)c2c1.CN(CCN)Cc1cn[nH]c1-c1ccc2ncnn2c1
• InChI: InChI=1S/C17H21N5.C16H21N5.C13H17N7.C13H21N5O.C13H21N5.C12H20N5/c1-3-9-21(2)12-14-10-18-20-17(14)15-11-19-22(13-15)16-7-5-4-6-8-16;1-20(8-6-17)11-14-10-18-19-16(14)13-4-3-12-5-7-21(2)15(12)9-13;1-19(5-4-14)7-11-6-16-18-13(11)10-2-3-12-15-9-17-20(12)8-10;1-3-4-17(2)9-11-7-14-16-13(11)12-8-15-18(10-12)5-6-19;1-4-6-17(3)9-11-7-14-16-13(11)12-8-15-18(5-2)10-12;1-4-7-16(2)9-10-8-13-15-12(10)11-5-6-14-17(11)3/h4-8,10-11,13H,3,9,12H2,1-2H3,(H,18,20);3-5,7,9-10H,6,8,11,17H2,1-2H3,(H,18,19);2-3,6,8-9H,4-5,7,14H2,1H3,(H,16,18);7-8,10,19H,3-6,9H2,1-2H3,(H,14,16);7-8,10H,4-6,9H2,1-3H3,(H,14,16);5,8H,4,6-7,9H2,1-3H3,(H,13,15)/q;;;;;+1
• InChIKey: XNXGDOWCRCALDU-UHFFFAOYSA-N
• XLogP: 10.52
• TPSA: 367.74 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 26
• Rotatable Bonds: 34
• Heavy Atoms: 117
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1595.11
LogP ≤ 5	10.52
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine?

The IUPAC name of N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine (CID 159798378) is N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine.

What is the SMILES notation for N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine?

The canonical SMILES for N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine is CCCN(C)Cc1cn[nH]c1-c1cnn(-c2ccccc2)c1.CCCN(C)Cc1cn[nH]c1-c1cnn(CC)c1.CCCN(C)Cc1cn[nH]c1-c1cnn(CCO)c1.CCCN(C)Cc1cn[nH]c1C1=CCN=[N+]1C.CN(CCN)Cc1cn[nH]c1-c1ccc2ccn(C)c2c1.CN(CCN)Cc1cn[nH]c1-c1ccc2ncnn2c1.

What is the InChIKey of N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine?

The InChIKey is XNXGDOWCRCALDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5.C16H21N5.C13H17N7.C13H21N5O.C13H21N5.C12H20N5/c1-3-9-21(2)12-14-10-18-20-17(14)15-11-19-22(13-15)16-7-5-4-6-8-16;1-20(8-6-17)11-14-10-18-19-16(14)13-4-3-12-5-7-21(2)15(12)9-13;1-19(5-4-14)7-11-6-16-18-13(11)10-2-3-12-15-9-17-20(12)8-10;1-3-4-17(2)9-11-7-14-16-13(11)12-8-15-18(10-12)5-6-19;1-4-6-17(3)9-11-7-14-16-13(11)12-8-15-18(5-2)10-12;1-4-7-16(2)9-10-8-13-15-12(10)11-5-6-14-17(11)3/h4-8,10-11,13H,3,9,12H2,1-2H3,(H,18,20);3-5,7,9-10H,6,8,11,17H2,1-2H3,(H,18,19);2-3,6,8-9H,4-5,7,14H2,1H3,(H,16,18);7-8,10,19H,3-6,9H2,1-2H3,(H,14,16);7-8,10H,4-6,9H2,1-3H3,(H,14,16);5,8H,4,6-7,9H2,1-3H3,(H,13,15)/q;;;;;+1.

What are the key properties of N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine?

N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine has a molecular weight of 1595.11 g/mol, XLogP of 10.52, 34 rotatable bonds, 9 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[5-(1-ethylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]-N-methylpropan-1-amine;N'-methyl-N'-[[5-(1-methylindol-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine;N-methyl-N-[[5-(1-methyl-3H-pyrazol-1-ium-5-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;N-methyl-N-[[5-(1-phenylpyrazol-4-yl)-1H-pyrazol-4-yl]methyl]propan-1-amine;2-[4-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyrazol-1-yl]ethanol;N'-methyl-N'-[[5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-pyrazol-4-yl]methyl]ethane-1,2-diamine is sourced from PubChem (CID 159798378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).