2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride

C54H75Cl3N22O4 — CID 160741519

About 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride

2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride (PubChem CID 160741519) has the molecular formula C54H75Cl3N22O4 and a molecular weight of 1202.70 g/mol. Its IUPAC name is 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride.

Molecular Properties

• Compound Name: 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride
• PubChem CID: 160741519
• Molecular Formula: C54H75Cl3N22O4
• Molecular Weight: 1202.70 g/mol
• Exact Mass: 1200.54
• IUPAC Name: 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride
• SMILES: C.CN(C)CCn1cc2ccc(N)cc2n1.CN(C)CCn1cc2ccc([N+](=O)[O-])cc2n1.CNCCCl.CNc1ccnc(Cl)n1.CNc1ccnc(Nc2ccc3cn(CCN(C)C)nc3c2)n1.Cl.O=[N+]([O-])c1ccc2cn[nH]c2c1
• InChI: InChI=1S/C16H21N7.C11H14N4O2.C11H16N4.C7H5N3O2.C5H6ClN3.C3H8ClN.CH4.ClH/c1-17-15-6-7-18-16(20-15)19-13-5-4-12-11-23(9-8-22(2)3)21-14(12)10-13;1-13(2)5-6-14-8-9-3-4-10(15(16)17)7-11(9)12-14;1-14(2)5-6-15-8-9-3-4-10(12)7-11(9)13-15;11-10(12)6-2-1-5-4-8-9-7(5)3-6;1-7-4-2-3-8-5(6)9-4;1-5-3-2-4;;/h4-7,10-11H,8-9H2,1-3H3,(H2,17,18,19,20);3-4,7-8H,5-6H2,1-2H3;3-4,7-8H,5-6,12H2,1-2H3;1-4H,(H,8,9);2-3H,1H3,(H,7,8,9);5H,2-3H2,1H3;1H4;1H
• InChIKey: URZWORKAOPISKB-UHFFFAOYSA-N
• XLogP: 9.00
• TPSA: 303.84 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 23
• Rotatable Bonds: 17
• Heavy Atoms: 83
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1202.70
LogP ≤ 5	9.00
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride?

The IUPAC name of 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride (CID 160741519) is 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride.

What is the SMILES notation for 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride?

The canonical SMILES for 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride is C.CN(C)CCn1cc2ccc(N)cc2n1.CN(C)CCn1cc2ccc([N+](=O)[O-])cc2n1.CNCCCl.CNc1ccnc(Cl)n1.CNc1ccnc(Nc2ccc3cn(CCN(C)C)nc3c2)n1.Cl.O=[N+]([O-])c1ccc2cn[nH]c2c1.

What is the InChIKey of 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride?

The InChIKey is URZWORKAOPISKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N7.C11H14N4O2.C11H16N4.C7H5N3O2.C5H6ClN3.C3H8ClN.CH4.ClH/c1-17-15-6-7-18-16(20-15)19-13-5-4-12-11-23(9-8-22(2)3)21-14(12)10-13;1-13(2)5-6-14-8-9-3-4-10(15(16)17)7-11(9)12-14;1-14(2)5-6-15-8-9-3-4-10(12)7-11(9)13-15;11-10(12)6-2-1-5-4-8-9-7(5)3-6;1-7-4-2-3-8-5(6)9-4;1-5-3-2-4;;/h4-7,10-11H,8-9H2,1-3H3,(H2,17,18,19,20);3-4,7-8H,5-6H2,1-2H3;3-4,7-8H,5-6,12H2,1-2H3;1-4H,(H,8,9);2-3H,1H3,(H,7,8,9);5H,2-3H2,1H3;1H4;1H.

What are the key properties of 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride?

2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride has a molecular weight of 1202.70 g/mol, XLogP of 9.00, 17 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-N-methylethanamine;2-chloro-N-methylpyrimidin-4-amine;2-[2-(dimethylamino)ethyl]indazol-6-amine;2-N-[2-[2-(dimethylamino)ethyl]indazol-6-yl]-4-N-methylpyrimidine-2,4-diamine;N,N-dimethyl-2-(6-nitroindazol-2-yl)ethanamine;methane;6-nitro-1H-indazole;hydrochloride is sourced from PubChem (CID 160741519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).