7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

C65H104B2Br2Cl4N14O4 — CID 160656250

About 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole (PubChem CID 160656250) has the molecular formula C65H104B2Br2Cl4N14O4 and a molecular weight of 1468.88 g/mol. Its IUPAC name is 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole.

Molecular Properties

• Compound Name: 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
• PubChem CID: 160656250
• Molecular Formula: C65H104B2Br2Cl4N14O4
• Molecular Weight: 1468.88 g/mol
• Exact Mass: 1464.57
• IUPAC Name: 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
• SMILES: CC1(C)OB(c2cn[nH]c2)OC1(C)C.CCN(CC)CCCCl.CCN(CC)CCCn1cc(-c2cnc3ccc(Cl)nc3c2)cn1.CCN(CC)CCCn1cc(B2OC(C)(C)C(C)(C)O2)cn1.CCNCC.ClCCCBr.Clc1ccc2ncc(Br)cc2n1
• InChI: InChI=1S/C18H22ClN5.C16H30BN3O2.C9H15BN2O2.C8H4BrClN2.C7H16ClN.C4H11N.C3H6BrCl/c1-3-23(4-2)8-5-9-24-13-15(12-21-24)14-10-17-16(20-11-14)6-7-18(19)22-17;1-7-19(8-2)10-9-11-20-13-14(12-18-20)17-21-15(3,4)16(5,6)22-17;1-8(2)9(3,4)14-10(13-8)7-5-11-12-6-7;9-5-3-7-6(11-4-5)1-2-8(10)12-7;1-3-9(4-2)7-5-6-8;1-3-5-4-2;4-2-1-3-5/h6-7,10-13H,3-5,8-9H2,1-2H3;12-13H,7-11H2,1-6H3;5-6H,1-4H3,(H,11,12);1-4H;3-7H2,1-2H3;5H,3-4H2,1-2H3;1-3H2
• InChIKey: RLBWJGCIPIMEEY-UHFFFAOYSA-N
• XLogP: 14.13
• TPSA: 174.55 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 17
• Rotatable Bonds: 24
• Heavy Atoms: 91
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1468.88
LogP ≤ 5	14.13
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole?

The IUPAC name of 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole (CID 160656250) is 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole.

What is the SMILES notation for 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole?

The canonical SMILES for 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole is CC1(C)OB(c2cn[nH]c2)OC1(C)C.CCN(CC)CCCCl.CCN(CC)CCCn1cc(-c2cnc3ccc(Cl)nc3c2)cn1.CCN(CC)CCCn1cc(B2OC(C)(C)C(C)(C)O2)cn1.CCNCC.ClCCCBr.Clc1ccc2ncc(Br)cc2n1.

What is the InChIKey of 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole?

The InChIKey is RLBWJGCIPIMEEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22ClN5.C16H30BN3O2.C9H15BN2O2.C8H4BrClN2.C7H16ClN.C4H11N.C3H6BrCl/c1-3-23(4-2)8-5-9-24-13-15(12-21-24)14-10-17-16(20-11-14)6-7-18(19)22-17;1-7-19(8-2)10-9-11-20-13-14(12-18-20)17-21-15(3,4)16(5,6)22-17;1-8(2)9(3,4)14-10(13-8)7-5-11-12-6-7;9-5-3-7-6(11-4-5)1-2-8(10)12-7;1-3-9(4-2)7-5-6-8;1-3-5-4-2;4-2-1-3-5/h6-7,10-13H,3-5,8-9H2,1-2H3;12-13H,7-11H2,1-6H3;5-6H,1-4H3,(H,11,12);1-4H;3-7H2,1-2H3;5H,3-4H2,1-2H3;1-3H2.

What are the key properties of 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole?

7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole has a molecular weight of 1468.88 g/mol, XLogP of 14.13, 24 rotatable bonds, 2 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-2-chloro-1,5-naphthyridine;1-bromo-3-chloropropane;3-chloro-N,N-diethylpropan-1-amine;3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]-N,N-diethylpropan-1-amine;N,N-diethyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]propan-1-amine;N-ethylethanamine;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole is sourced from PubChem (CID 160656250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).