5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide

C99H116FN19O7 — CID 158450643

About 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide

5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide (PubChem CID 158450643) has the molecular formula C99H116FN19O7 and a molecular weight of 1703.14 g/mol. Its IUPAC name is 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide.

Molecular Properties

• Compound Name: 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide
• PubChem CID: 158450643
• Molecular Formula: C99H116FN19O7
• Molecular Weight: 1703.14 g/mol
• Exact Mass: 1701.93
• IUPAC Name: 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide
• SMILES: Cc1cc(CNc2n[nH]c(Cc3ccc(CN4CCOCC4)cc3)c2C(N)=O)cc(C)c1C.Cc1cc(CNc2n[nH]c(Cc3ccc(N(C)C)cc3)c2C(N)=O)cc(C)c1C.Cc1cc(CNc2n[nH]c(Cc3ccc(NC(=O)c4ccc(F)cc4)cc3)c2C(N)=O)cc(C)c1C.Cc1cc(CNc2n[nH]c(Cc3cccc(CO)c3)c2C(N)=O)cc(C)c1C
• InChI: InChI=1S/C28H28FN5O2.C26H33N5O2.C23H29N5O.C22H26N4O2/c1-16-12-20(13-17(2)18(16)3)15-31-27-25(26(30)35)24(33-34-27)14-19-4-10-23(11-5-19)32-28(36)21-6-8-22(29)9-7-21;1-17-12-22(13-18(2)19(17)3)15-28-26-24(25(27)32)23(29-30-26)14-20-4-6-21(7-5-20)16-31-8-10-33-11-9-31;1-14-10-18(11-15(2)16(14)3)13-25-23-21(22(24)29)20(26-27-23)12-17-6-8-19(9-7-17)28(4)5;1-13-7-18(8-14(2)15(13)3)11-24-22-20(21(23)28)19(25-26-22)10-16-5-4-6-17(9-16)12-27/h4-13H,14-15H2,1-3H3,(H2,30,35)(H,32,36)(H2,31,33,34);4-7,12-13H,8-11,14-16H2,1-3H3,(H2,27,32)(H2,28,29,30);6-11H,12-13H2,1-5H3,(H2,24,29)(H2,25,26,27);4-9,27H,10-12H2,1-3H3,(H2,23,28)(H2,24,25,26)
• InChIKey: HDYAHZANWMFWSP-UHFFFAOYSA-N
• XLogP: 15.33
• TPSA: 400.24 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 17
• Rotatable Bonds: 30
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1703.14
LogP ≤ 5	15.33
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide?

The IUPAC name of 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide (CID 158450643) is 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide.

What is the SMILES notation for 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide?

The canonical SMILES for 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide is Cc1cc(CNc2n[nH]c(Cc3ccc(CN4CCOCC4)cc3)c2C(N)=O)cc(C)c1C.Cc1cc(CNc2n[nH]c(Cc3ccc(N(C)C)cc3)c2C(N)=O)cc(C)c1C.Cc1cc(CNc2n[nH]c(Cc3ccc(NC(=O)c4ccc(F)cc4)cc3)c2C(N)=O)cc(C)c1C.Cc1cc(CNc2n[nH]c(Cc3cccc(CO)c3)c2C(N)=O)cc(C)c1C.

What is the InChIKey of 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide?

The InChIKey is HDYAHZANWMFWSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28FN5O2.C26H33N5O2.C23H29N5O.C22H26N4O2/c1-16-12-20(13-17(2)18(16)3)15-31-27-25(26(30)35)24(33-34-27)14-19-4-10-23(11-5-19)32-28(36)21-6-8-22(29)9-7-21;1-17-12-22(13-18(2)19(17)3)15-28-26-24(25(27)32)23(29-30-26)14-20-4-6-21(7-5-20)16-31-8-10-33-11-9-31;1-14-10-18(11-15(2)16(14)3)13-25-23-21(22(24)29)20(26-27-23)12-17-6-8-19(9-7-17)28(4)5;1-13-7-18(8-14(2)15(13)3)11-24-22-20(21(23)28)19(25-26-22)10-16-5-4-6-17(9-16)12-27/h4-13H,14-15H2,1-3H3,(H2,30,35)(H,32,36)(H2,31,33,34);4-7,12-13H,8-11,14-16H2,1-3H3,(H2,27,32)(H2,28,29,30);6-11H,12-13H2,1-5H3,(H2,24,29)(H2,25,26,27);4-9,27H,10-12H2,1-3H3,(H2,23,28)(H2,24,25,26).

What are the key properties of 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide?

5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide has a molecular weight of 1703.14 g/mol, XLogP of 15.33, 30 rotatable bonds, 14 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[[4-(dimethylamino)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[3-(hydroxymethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-[(3,4,5-trimethylphenyl)methylamino]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 158450643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).