1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine

C107H137Br3N20O20 — CID 165084761

About 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine

1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine (PubChem CID 165084761) has the molecular formula C107H137Br3N20O20 and a molecular weight of 2263.10 g/mol. Its IUPAC name is 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine.

Molecular Properties

• Compound Name: 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine
• PubChem CID: 165084761
• Molecular Formula: C107H137Br3N20O20
• Molecular Weight: 2263.10 g/mol
• Exact Mass: 2258.79
• IUPAC Name: 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine
• SMILES: CC(C)(C)OC(=O)NC1(c2ccc(Br)cn2)CC1.CN(C(=O)OC(C)(C)C)C1(c2ccc(Br)cn2)CC1.CN(C(=O)c1cnn2c1CN(C(=O)OC(C)(C)C)CC2)C1(c2ccccn2)CC1.CNC1(c2ccc(C)cn2)CC1.Cc1ccc(C2(N(C)C(=O)OC(C)(C)C)CC2)nc1.Cc1ccc(C2(N(C)C(=O)c3cnn4c3CN(C(=O)OC(C)(C)C)CC4)CC2)nc1.NC1(c2ccc(Br)cn2)CC1.O=C=O.O=C=O.O=C=O.O=C=O
• InChI: InChI=1S/C22H29N5O3.C21H27N5O3.C15H22N2O2.C14H19BrN2O2.C13H17BrN2O2.C10H14N2.C8H9BrN2.4CO2/c1-15-6-7-18(23-12-15)22(8-9-22)25(5)19(28)16-13-24-27-11-10-26(14-17(16)27)20(29)30-21(2,3)4;1-20(2,3)29-19(28)25-11-12-26-16(14-25)15(13-23-26)18(27)24(4)21(8-9-21)17-7-5-6-10-22-17;1-11-6-7-12(16-10-11)15(8-9-15)17(5)13(18)19-14(2,3)4;1-13(2,3)19-12(18)17(4)14(7-8-14)11-6-5-10(15)9-16-11;1-12(2,3)18-11(17)16-13(6-7-13)10-5-4-9(14)8-15-10;1-8-3-4-9(12-7-8)10(11-2)5-6-10;9-6-1-2-7(11-5-6)8(10)3-4-8;4*2-1-3/h6-7,12-13H,8-11,14H2,1-5H3;5-7,10,13H,8-9,11-12,14H2,1-4H3;6-7,10H,8-9H2,1-5H3;5-6,9H,7-8H2,1-4H3;4-5,8H,6-7H2,1-3H3,(H,16,17);3-4,7,11H,5-6H2,1-2H3;1-2,5H,3-4,10H2
• InChIKey: VSAZUBFFMQCYMX-UHFFFAOYSA-N
• XLogP: 17.25
• TPSA: 497.59 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 33
• Rotatable Bonds: 15
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2263.10
LogP ≤ 5	17.25
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine?

The IUPAC name of 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine (CID 165084761) is 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine.

What is the SMILES notation for 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine?

The canonical SMILES for 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine is CC(C)(C)OC(=O)NC1(c2ccc(Br)cn2)CC1.CN(C(=O)OC(C)(C)C)C1(c2ccc(Br)cn2)CC1.CN(C(=O)c1cnn2c1CN(C(=O)OC(C)(C)C)CC2)C1(c2ccccn2)CC1.CNC1(c2ccc(C)cn2)CC1.Cc1ccc(C2(N(C)C(=O)OC(C)(C)C)CC2)nc1.Cc1ccc(C2(N(C)C(=O)c3cnn4c3CN(C(=O)OC(C)(C)C)CC4)CC2)nc1.NC1(c2ccc(Br)cn2)CC1.O=C=O.O=C=O.O=C=O.O=C=O.

What is the InChIKey of 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine?

The InChIKey is VSAZUBFFMQCYMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N5O3.C21H27N5O3.C15H22N2O2.C14H19BrN2O2.C13H17BrN2O2.C10H14N2.C8H9BrN2.4CO2/c1-15-6-7-18(23-12-15)22(8-9-22)25(5)19(28)16-13-24-27-11-10-26(14-17(16)27)20(29)30-21(2,3)4;1-20(2,3)29-19(28)25-11-12-26-16(14-25)15(13-23-26)18(27)24(4)21(8-9-21)17-7-5-6-10-22-17;1-11-6-7-12(16-10-11)15(8-9-15)17(5)13(18)19-14(2,3)4;1-13(2,3)19-12(18)17(4)14(7-8-14)11-6-5-10(15)9-16-11;1-12(2,3)18-11(17)16-13(6-7-13)10-5-4-9(14)8-15-10;1-8-3-4-9(12-7-8)10(11-2)5-6-10;9-6-1-2-7(11-5-6)8(10)3-4-8;4*2-1-3/h6-7,12-13H,8-11,14H2,1-5H3;5-7,10,13H,8-9,11-12,14H2,1-4H3;6-7,10H,8-9H2,1-5H3;5-6,9H,7-8H2,1-4H3;4-5,8H,6-7H2,1-3H3,(H,16,17);3-4,7,11H,5-6H2,1-2H3;1-2,5H,3-4,10H2;;;;.

What are the key properties of 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine?

1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine has a molecular weight of 2263.10 g/mol, XLogP of 17.25, 15 rotatable bonds, 3 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(5-bromo-2-pyridinyl)cyclopropan-1-amine;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]carbamate;tert-butyl N-[1-(5-bromo-2-pyridinyl)cyclopropyl]-N-methylcarbamate;tert-butyl N-methyl-N-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamate;tert-butyl 3-[methyl-[1-(5-methyl-2-pyridinyl)cyclopropyl]carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-[methyl-(1-pyridin-2-ylcyclopropyl)carbamoyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tetrakis(carbon dioxide);N-methyl-1-(5-methyl-2-pyridinyl)cyclopropan-1-amine is sourced from PubChem (CID 165084761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).