7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride

C132H167BrCl7N19O12 — CID 161007989

About 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride

7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride (PubChem CID 161007989) has the molecular formula C132H167BrCl7N19O12 and a molecular weight of 2539.98 g/mol. Its IUPAC name is 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride.

Molecular Properties

• Compound Name: 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride
• PubChem CID: 161007989
• Molecular Formula: C132H167BrCl7N19O12
• Molecular Weight: 2539.98 g/mol
• Exact Mass: 2534.00
• IUPAC Name: 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride
• SMILES: C1CCOC1.CN(C)CCCCl.COc1cc(O)c(-c2cn3ccc(N4CCCCCC4)cc3n2)cc1Cl.COc1cc(OCCCN(C)C)c(-c2cn3ccc(N4CCCCCC4)cc3n2)cc1Cl.COc1cc(OCCCN(C)C)c(-c2cn3ccc(N4CCCNCC4)cc3n2)cc1Cl.COc1cc(OCc2ccccc2)c(-c2cn3ccc(N4CCCCCC4)cc3n2)cc1Cl.Cl.Nc1cc(N2CCCCCC2)ccn1.O=C(CBr)c1cc(Cl)c(CO)cc1OCc1ccccc1
• InChI: InChI=1S/C27H28ClN3O2.C25H33ClN4O2.C24H32ClN5O2.C20H22ClN3O2.C16H14BrClO3.C11H17N3.C5H12ClN.C4H8O.ClH/c1-32-26-17-25(33-19-20-9-5-4-6-10-20)22(16-23(26)28)24-18-31-14-11-21(15-27(31)29-24)30-12-7-2-3-8-13-30;1-28(2)10-8-14-32-23-17-24(31-3)21(26)16-20(23)22-18-30-13-9-19(15-25(30)27-22)29-11-6-4-5-7-12-29;1-28(2)9-5-13-32-22-16-23(31-3)20(25)15-19(22)21-17-30-11-6-18(14-24(30)27-21)29-10-4-7-26-8-12-29;1-26-19-12-18(25)15(11-16(19)21)17-13-24-9-6-14(10-20(24)22-17)23-7-4-2-3-5-8-23;17-8-15(20)13-7-14(18)12(9-19)6-16(13)21-10-11-4-2-1-3-5-11;12-11-9-10(5-6-13-11)14-7-3-1-2-4-8-14;1-7(2)5-3-4-6;1-2-4-5-3-1;/h4-6,9-11,14-18H,2-3,7-8,12-13,19H2,1H3;9,13,15-18H,4-8,10-12,14H2,1-3H3;6,11,14-17,26H,4-5,7-10,12-13H2,1-3H3;6,9-13,25H,2-5,7-8H2,1H3;1-7,19H,8-10H2;5-6,9H,1-4,7-8H2,(H2,12,13);3-5H2,1-2H3;1-4H2;1H
• InChIKey: ZVAHQWQTRLWKKH-UHFFFAOYSA-N
• XLogP: 28.97
• TPSA: 286.66 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 31
• Rotatable Bonds: 35
• Heavy Atoms: 171
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2539.98
LogP ≤ 5	28.97
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride?

The IUPAC name of 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride (CID 161007989) is 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride.

What is the SMILES notation for 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride?

The canonical SMILES for 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride is C1CCOC1.CN(C)CCCCl.COc1cc(O)c(-c2cn3ccc(N4CCCCCC4)cc3n2)cc1Cl.COc1cc(OCCCN(C)C)c(-c2cn3ccc(N4CCCCCC4)cc3n2)cc1Cl.COc1cc(OCCCN(C)C)c(-c2cn3ccc(N4CCCNCC4)cc3n2)cc1Cl.COc1cc(OCc2ccccc2)c(-c2cn3ccc(N4CCCCCC4)cc3n2)cc1Cl.Cl.Nc1cc(N2CCCCCC2)ccn1.O=C(CBr)c1cc(Cl)c(CO)cc1OCc1ccccc1.

What is the InChIKey of 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride?

The InChIKey is ZVAHQWQTRLWKKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28ClN3O2.C25H33ClN4O2.C24H32ClN5O2.C20H22ClN3O2.C16H14BrClO3.C11H17N3.C5H12ClN.C4H8O.ClH/c1-32-26-17-25(33-19-20-9-5-4-6-10-20)22(16-23(26)28)24-18-31-14-11-21(15-27(31)29-24)30-12-7-2-3-8-13-30;1-28(2)10-8-14-32-23-17-24(31-3)21(26)16-20(23)22-18-30-13-9-19(15-25(30)27-22)29-11-6-4-5-7-12-29;1-28(2)9-5-13-32-22-16-23(31-3)20(25)15-19(22)21-17-30-11-6-18(14-24(30)27-21)29-10-4-7-26-8-12-29;1-26-19-12-18(25)15(11-16(19)21)17-13-24-9-6-14(10-20(24)22-17)23-7-4-2-3-5-8-23;17-8-15(20)13-7-14(18)12(9-19)6-16(13)21-10-11-4-2-1-3-5-11;12-11-9-10(5-6-13-11)14-7-3-1-2-4-8-14;1-7(2)5-3-4-6;1-2-4-5-3-1;/h4-6,9-11,14-18H,2-3,7-8,12-13,19H2,1H3;9,13,15-18H,4-8,10-12,14H2,1-3H3;6,11,14-17,26H,4-5,7-10,12-13H2,1-3H3;6,9-13,25H,2-5,7-8H2,1H3;1-7,19H,8-10H2;5-6,9H,1-4,7-8H2,(H2,12,13);3-5H2,1-2H3;1-4H2;1H.

What are the key properties of 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride?

7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride has a molecular weight of 2539.98 g/mol, XLogP of 28.97, 35 rotatable bonds, 4 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(azepan-1-yl)-2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)imidazo[1,2-a]pyridine;2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenol;3-[2-[7-(azepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;4-(azepan-1-yl)pyridin-2-amine;2-bromo-1-[5-chloro-4-(hydroxymethyl)-2-phenylmethoxyphenyl]ethanone;3-[4-chloro-2-[7-(1,4-diazepan-1-yl)imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenoxy]-N,N-dimethylpropan-1-amine;3-chloro-N,N-dimethylpropan-1-amine;oxolane;hydrochloride is sourced from PubChem (CID 161007989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).