2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide

C102H132N20O14 — CID 164956557

About 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide

2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 164956557) has the molecular formula C102H132N20O14 and a molecular weight of 1867.33 g/mol. Its IUPAC name is 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
• PubChem CID: 164956557
• Molecular Formula: C102H132N20O14
• Molecular Weight: 1867.33 g/mol
• Exact Mass: 1866.05
• IUPAC Name: 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
• SMILES: C=CC(=O)N1CCC(C2CCNc3c(C(N)=O)c(-c4cc(C)c(C5CC5)c(OC)c4)nn32)CC1.C=CC(=O)N1CCC(C2CCNc3c(C(N)=O)c(-c4cc(CC)c(C)c(OC)c4)nn32)CC1.[2H]/C(C)=C(\[2H])C(=O)N1CCC(C2CCNc3c(C(N)=O)c(-c4cc(OC)c(C)c(OC)c4)nn32)CC1.[2H]C([2H])([2H])Oc1cc(-c2nn3c(c2C(N)=O)NCCC3C2CCN(C(=O)C=C)CC2)cc(OC)c1C1CC1
• InChI: InChI=1S/C26H33N5O4.C26H33N5O3.C25H33N5O4.C25H33N5O3/c1-4-21(32)30-11-8-15(9-12-30)18-7-10-28-26-23(25(27)33)24(29-31(18)26)17-13-19(34-2)22(16-5-6-16)20(14-17)35-3;1-4-21(32)30-11-8-16(9-12-30)19-7-10-28-26-23(25(27)33)24(29-31(19)26)18-13-15(2)22(17-5-6-17)20(14-18)34-3;1-5-6-21(31)29-11-8-16(9-12-29)18-7-10-27-25-22(24(26)32)23(28-30(18)25)17-13-19(33-3)15(2)20(14-17)34-4;1-5-16-13-18(14-20(33-4)15(16)3)23-22(24(26)32)25-27-10-7-19(30(25)28-23)17-8-11-29(12-9-17)21(31)6-2/h4,13-16,18,28H,1,5-12H2,2-3H3,(H2,27,33);4,13-14,16-17,19,28H,1,5-12H2,2-3H3,(H2,27,33);5-6,13-14,16,18,27H,7-12H2,1-4H3,(H2,26,32);6,13-14,17,19,27H,2,5,7-12H2,1,3-4H3,(H2,26,32)/b;;6-5-;/i2D3;;5D,6D
• InChIKey: BGFYTKHKHLLWRD-ZOGHAMSGSA-N
• XLogP: 13.41
• TPSA: 428.38 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 26
• Rotatable Bonds: 26
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1867.33
LogP ≤ 5	13.41
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide?

The IUPAC name of 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 164956557) is 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide.

What is the SMILES notation for 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide?

The canonical SMILES for 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide is C=CC(=O)N1CCC(C2CCNc3c(C(N)=O)c(-c4cc(C)c(C5CC5)c(OC)c4)nn32)CC1.C=CC(=O)N1CCC(C2CCNc3c(C(N)=O)c(-c4cc(CC)c(C)c(OC)c4)nn32)CC1.[2H]/C(C)=C(\[2H])C(=O)N1CCC(C2CCNc3c(C(N)=O)c(-c4cc(OC)c(C)c(OC)c4)nn32)CC1.[2H]C([2H])([2H])Oc1cc(-c2nn3c(c2C(N)=O)NCCC3C2CCN(C(=O)C=C)CC2)cc(OC)c1C1CC1.

What is the InChIKey of 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide?

The InChIKey is BGFYTKHKHLLWRD-ZOGHAMSGSA-N. The full InChI is InChI=1S/C26H33N5O4.C26H33N5O3.C25H33N5O4.C25H33N5O3/c1-4-21(32)30-11-8-15(9-12-30)18-7-10-28-26-23(25(27)33)24(29-31(18)26)17-13-19(34-2)22(16-5-6-16)20(14-17)35-3;1-4-21(32)30-11-8-16(9-12-30)19-7-10-28-26-23(25(27)33)24(29-31(19)26)18-13-15(2)22(17-5-6-17)20(14-18)34-3;1-5-6-21(31)29-11-8-16(9-12-29)18-7-10-27-25-22(24(26)32)23(28-30(18)25)17-13-19(33-3)15(2)20(14-17)34-4;1-5-16-13-18(14-20(33-4)15(16)3)23-22(24(26)32)25-27-10-7-19(30(25)28-23)17-8-11-29(12-9-17)21(31)6-2/h4,13-16,18,28H,1,5-12H2,2-3H3,(H2,27,33);4,13-14,16-17,19,28H,1,5-12H2,2-3H3,(H2,27,33);5-6,13-14,16,18,27H,7-12H2,1-4H3,(H2,26,32);6,13-14,17,19,27H,2,5,7-12H2,1,3-4H3,(H2,26,32)/b;;6-5-;/i2D3;;5D,6D;.

What are the key properties of 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide?

2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 1867.33 g/mol, XLogP of 13.41, 26 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-cyclopropyl-3-methoxy-5-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-[4-cyclopropyl-3-methoxy-5-(trideuteriomethoxy)phenyl]-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[1-[(Z)-2,3-dideuteriobut-2-enoyl]piperidin-4-yl]-2-(3,5-dimethoxy-4-methylphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-(3-ethyl-5-methoxy-4-methylphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 164956557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).