N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine

C142H158ClN11O6S — CID 161129199

IUPACN-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine
SMILESCCCCc1ccc(OCCN(c2ccccc2)c2cc(C)ccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2cc(Cl)ccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2ccccc2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2ccccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2cccnc2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2nc3ccccc3s2)cc1
InChIInChI=1S/C25H26N2OS.C24H28N2O.C24H27NO.C23H25ClN2O.2C23H26N2O/c1-2-3-9-20-14-16-22(17-15-20)28-19-18-27(21-10-5-4-6-11-21)25-26-23-12-7-8-13-24(23)29-25;1-3-4-8-21-11-13-23(14-12-21)27-18-17-26(22-9-6-5-7-10-22)24-19-20(2)15-16-25-24;1-2-3-10-21-15-17-24(18-16-21)26-20-19-25(22-11-6-4-7-12-22)23-13-8-5-9-14-23;1-2-3-7-19-10-12-22(13-11-19)27-17-16-26(21-8-5-4-6-9-21)23-18-20(24)14-15-25-23;1-2-3-9-20-13-15-22(16-14-20)26-19-18-25(21-10-5-4-6-11-21)23-12-7-8-17-24-23;1-2-3-8-20-12-14-23(15-13-20)26-18-17-25(21-9-5-4-6-10-21)22-11-7-16-24-19-22/h4-8,10-17H,2-3,9,18-19H2,1H3;5-7,9-16,19H,3-4,8,17-18H2,1-2H3;4-9,11-18H,2-3,10,19-20H2,1H3;4-6,8-15,18H,2-3,7,16-17H2,1H3;4-8,10-17H,2-3,9,18-19H2,1H3;4-7,9-16,19H,2-3,8,17-18H2,1H3
InChIKeyULYOYDFWGPKWSC-UHFFFAOYSA-N
MW2182.42 g/mol
LogP36.63
Rot. Bonds54

About N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine

N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine (PubChem CID 161129199) has the molecular formula C142H158ClN11O6S and a molecular weight of 2182.42 g/mol. Its IUPAC name is N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine.

Molecular Properties

Compound NameN-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine
PubChem CID161129199
Molecular FormulaC142H158ClN11O6S
Molecular Weight2182.42 g/mol
Exact Mass2180.18
IUPAC NameN-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine
SMILESCCCCc1ccc(OCCN(c2ccccc2)c2cc(C)ccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2cc(Cl)ccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2ccccc2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2ccccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2cccnc2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2nc3ccccc3s2)cc1
InChIInChI=1S/C25H26N2OS.C24H28N2O.C24H27NO.C23H25ClN2O.2C23H26N2O/c1-2-3-9-20-14-16-22(17-15-20)28-19-18-27(21-10-5-4-6-11-21)25-26-23-12-7-8-13-24(23)29-25;1-3-4-8-21-11-13-23(14-12-21)27-18-17-26(22-9-6-5-7-10-22)24-19-20(2)15-16-25-24;1-2-3-10-21-15-17-24(18-16-21)26-20-19-25(22-11-6-4-7-12-22)23-13-8-5-9-14-23;1-2-3-7-19-10-12-22(13-11-19)27-17-16-26(21-8-5-4-6-9-21)23-18-20(24)14-15-25-23;1-2-3-9-20-13-15-22(16-14-20)26-19-18-25(21-10-5-4-6-11-21)23-12-7-8-17-24-23;1-2-3-8-20-12-14-23(15-13-20)26-18-17-25(21-9-5-4-6-10-21)22-11-7-16-24-19-22/h4-8,10-17H,2-3,9,18-19H2,1H3;5-7,9-16,19H,3-4,8,17-18H2,1-2H3;4-9,11-18H,2-3,10,19-20H2,1H3;4-6,8-15,18H,2-3,7,16-17H2,1H3;4-8,10-17H,2-3,9,18-19H2,1H3;4-7,9-16,19H,2-3,8,17-18H2,1H3
InChIKeyULYOYDFWGPKWSC-UHFFFAOYSA-N
XLogP36.63
TPSA139.27 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds54
Heavy Atoms161
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002182.42
LogP ≤ 536.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine with MolForge

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Related Compounds

N-[4-[3-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-yl]oxyphenyl]-1,3-benzothiazol-2-amine
CID 59351186
6-[[6-chloro-5-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3-pyridinyl]oxy]-N-cyclohexyl-1,3-benzothiazol-2-amine
CID 89225514
1-[6-[4-(1,3-Benzothiazol-2-ylamino)phenoxy]-5-morpholin-4-ylpyrazin-2-yl]-2-[1-[3-[4-(1,3-benzothiazol-2-ylamino)phenoxy]pyrazin-2-yl]piperidin-4-yl]propan-2-ol
CID 91550215
5-[[4-[[3-[(4-Chlorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methoxy]phenyl]methyl]-1,3-thiazole
CID 140967832
5-[[4-[(5-Chloro-3-methylimidazo[4,5-b]pyridin-2-yl)methoxy]phenyl]methyl]-1,3-thiazole
CID 140967846
N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-thiazol-2-amine
CID 157074013
4-N-[2-(4-butylphenoxy)ethyl]-1-N,1-N-dimethyl-4-N-pyridin-2-ylbenzene-1,4-diamine;N-[2-(4-butylphenoxy)ethyl]-6-methoxy-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-thiazol-2-amine
CID 158116354
4-[4-[2-[[6-(dimethylamino)-3-pyridinyl]-pyridin-2-ylamino]ethoxy]phenyl]butanoic acid;4-[4-[2-[pyridin-2-yl(pyridin-3-yl)amino]ethoxy]phenyl]butanoic acid;4-[4-[2-[N-(1,3-thiazol-2-yl)anilino]ethoxy]phenyl]butanoic acid
CID 158765391
4-[4-[2-[N-(1,3-benzothiazol-2-yl)anilino]ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(4-chloro-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(6-methoxy-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(4-methyl-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-phenylanilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-pyridin-3-ylanilino)ethoxy]phenyl]butanoic acid
CID 158904439
4-[4-[2-[N-(1,3-benzothiazol-2-yl)anilino]ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(4-chloro-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(6-methoxy-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(4-methyl-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(6-methyl-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-pyridin-3-ylanilino)ethoxy]phenyl]butanoic acid
CID 159748177
4-[4-[2-[N-(1,3-benzothiazol-2-yl)anilino]ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(4-chloro-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(6-methoxy-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(4-methyl-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-(6-methyl-2-pyridinyl)anilino)ethoxy]phenyl]butanoic acid;4-[4-[2-(N-pyrimidin-2-ylanilino)ethoxy]phenyl]butanoic acid
CID 161679030
2-[4-[2-(4-Pyridin-2-ylpiperazin-1-yl)ethyl]phenoxy]-1,3-benzothiazole
CID 173152680

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine?
The IUPAC name of N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine (CID 161129199) is N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine.
What is the SMILES notation for N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine?
The canonical SMILES for N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine is CCCCc1ccc(OCCN(c2ccccc2)c2cc(C)ccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2cc(Cl)ccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2ccccc2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2ccccn2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2cccnc2)cc1.CCCCc1ccc(OCCN(c2ccccc2)c2nc3ccccc3s2)cc1.
What is the InChIKey of N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine?
The InChIKey is ULYOYDFWGPKWSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2OS.C24H28N2O.C24H27NO.C23H25ClN2O.2C23H26N2O/c1-2-3-9-20-14-16-22(17-15-20)28-19-18-27(21-10-5-4-6-11-21)25-26-23-12-7-8-13-24(23)29-25;1-3-4-8-21-11-13-23(14-12-21)27-18-17-26(22-9-6-5-7-10-22)24-19-20(2)15-16-25-24;1-2-3-10-21-15-17-24(18-16-21)26-20-19-25(22-11-6-4-7-12-22)23-13-8-5-9-14-23;1-2-3-7-19-10-12-22(13-11-19)27-17-16-26(21-8-5-4-6-9-21)23-18-20(24)14-15-25-23;1-2-3-9-20-13-15-22(16-14-20)26-19-18-25(21-10-5-4-6-11-21)23-12-7-8-17-24-23;1-2-3-8-20-12-14-23(15-13-20)26-18-17-25(21-9-5-4-6-10-21)22-11-7-16-24-19-22/h4-8,10-17H,2-3,9,18-19H2,1H3;5-7,9-16,19H,3-4,8,17-18H2,1-2H3;4-9,11-18H,2-3,10,19-20H2,1H3;4-6,8-15,18H,2-3,7,16-17H2,1H3;4-8,10-17H,2-3,9,18-19H2,1H3;4-7,9-16,19H,2-3,8,17-18H2,1H3.
What are the key properties of N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine?
N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine has a molecular weight of 2182.42 g/mol, XLogP of 36.63, 54 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-butylphenoxy)ethyl]-4-chloro-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-4-methyl-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylaniline;N-[2-(4-butylphenoxy)ethyl]-N-phenyl-1,3-benzothiazol-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-2-amine;N-[2-(4-butylphenoxy)ethyl]-N-phenylpyridin-3-amine is sourced from PubChem (CID 161129199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).