N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine

C166H198N14O2S3 — CID 159840209

IUPACN-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine
SMILESc1cc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)cs1.c1ccc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)cc1.c1ccc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)nc1.c1ccc2nc(CNC34CC5CC(CC(C5)C3)C4)ccc2c1.c1coc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)c1.c1coc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)c1.c1csc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)c1.c1csc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)c1
InChIInChI=1S/C22H26N2.C21H25N3.C21H25NO.2C21H25NS.C20H24N2O.C20H24N2S.C20H24N2/c1-2-4-20(5-3-1)21-7-6-16(14-23-21)15-24-22-11-17-8-18(12-22)10-19(9-17)13-22;1-2-6-22-19(3-1)20-5-4-15(13-23-20)14-24-21-10-16-7-17(11-21)9-18(8-16)12-21;1-2-20(23-7-1)19-5-3-15(4-6-19)14-22-21-11-16-8-17(12-21)10-18(9-16)13-21;1-3-19(20-5-6-23-14-20)4-2-15(1)13-22-21-10-16-7-17(11-21)9-18(8-16)12-21;1-2-20(23-7-1)19-5-3-15(4-6-19)14-22-21-11-16-8-17(12-21)10-18(9-16)13-21;2*1-2-19(23-5-1)18-4-3-14(12-21-18)13-22-20-9-15-6-16(10-20)8-17(7-15)11-20;1-2-4-19-17(3-1)5-6-18(22-19)13-21-20-10-14-7-15(11-20)9-16(8-14)12-20/h1-7,14,17-19,24H,8-13,15H2;1-6,13,16-18,24H,7-12,14H2;1-7,16-18,22H,8-14H2;1-6,14,16-18,22H,7-13H2;1-7,16-18,22H,8-14H2;2*1-5,12,15-17,22H,6-11,13H2;1-6,14-16,21H,7-13H2
InChIKeyNOOUFEUVUMOCNS-UHFFFAOYSA-N
MW2517.71 g/mol
LogP38.52
Rot. Bonds31

About N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine

N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine (PubChem CID 159840209) has the molecular formula C166H198N14O2S3 and a molecular weight of 2517.71 g/mol. Its IUPAC name is N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine.

Molecular Properties

Compound NameN-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine
PubChem CID159840209
Molecular FormulaC166H198N14O2S3
Molecular Weight2517.71 g/mol
Exact Mass2515.50
IUPAC NameN-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine
SMILESc1cc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)cs1.c1ccc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)cc1.c1ccc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)nc1.c1ccc2nc(CNC34CC5CC(CC(C5)C3)C4)ccc2c1.c1coc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)c1.c1coc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)c1.c1csc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)c1.c1csc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)c1
InChIInChI=1S/C22H26N2.C21H25N3.C21H25NO.2C21H25NS.C20H24N2O.C20H24N2S.C20H24N2/c1-2-4-20(5-3-1)21-7-6-16(14-23-21)15-24-22-11-17-8-18(12-22)10-19(9-17)13-22;1-2-6-22-19(3-1)20-5-4-15(13-23-20)14-24-21-10-16-7-17(11-21)9-18(8-16)12-21;1-2-20(23-7-1)19-5-3-15(4-6-19)14-22-21-11-16-8-17(12-21)10-18(9-16)13-21;1-3-19(20-5-6-23-14-20)4-2-15(1)13-22-21-10-16-7-17(11-21)9-18(8-16)12-21;1-2-20(23-7-1)19-5-3-15(4-6-19)14-22-21-11-16-8-17(12-21)10-18(9-16)13-21;2*1-2-19(23-5-1)18-4-3-14(12-21-18)13-22-20-9-15-6-16(10-20)8-17(7-15)11-20;1-2-4-19-17(3-1)5-6-18(22-19)13-21-20-10-14-7-15(11-20)9-16(8-14)12-20/h1-7,14,17-19,24H,8-13,15H2;1-6,13,16-18,24H,7-12,14H2;1-7,16-18,22H,8-14H2;1-6,14,16-18,22H,7-13H2;1-7,16-18,22H,8-14H2;2*1-5,12,15-17,22H,6-11,13H2;1-6,14-16,21H,7-13H2
InChIKeyNOOUFEUVUMOCNS-UHFFFAOYSA-N
XLogP38.52
TPSA199.86 Ų
H-Bond Donors8
H-Bond Acceptors19
Rotatable Bonds31
Heavy Atoms185
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002517.71
LogP ≤ 538.52
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1019

Analyze N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine with MolForge

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Launch Full Analysis

Related Compounds

2-[[2-[2-[2-[2-[4-(furan-2-yl)-3-thiophen-2-yl-1H-pyrrol-2-yl]-3-pyridinyl]-1H-indol-3-yl]-1-benzofuran-3-yl]phenyl]sulfanyl-phenylmethyl]-3-isoquinolin-1-ylquinoline
CID 91399156
2-[[2-[2-[2-[2-[3-(furan-2-yl)-5-naphthalen-1-yl-4-(1H-pyrrol-2-yl)-2-thiophen-2-ylphenyl]-3-pyridinyl]-1H-indol-3-yl]-1-benzofuran-3-yl]phenyl]sulfanyl-phenylmethyl]-3-isoquinolin-1-ylquinoline
CID 123289308
4-[5-[5-[(1-adamantylamino)methyl]-2-pyridinyl]furan-2-yl]-N-[(6-thiophen-3-yl-3-pyridinyl)methyl]adamantan-1-amine
CID 123675596
2-[3-(1-azabicyclo[2.2.2]octan-3-yl)-1H-indol-5-yl]-1-(furan-2-yl)ethanimine;2-[3-(1-azabicyclo[2.2.2]octan-3-yl)-1H-indol-5-yl]-1-thiophen-2-ylethanimine;2-[3-(1-azabicyclo[2.2.2]oct-2-en-3-yl)-1H-indol-5-yl]-1-thiophen-2-ylethanimine
CID 123724688
6-[7-[5-(1,10-Phenanthrolin-2-yl)furan-2-yl]triphenylen-1-yl]-2-(5-triphenylen-2-ylthiophen-2-yl)-1,10-phenanthroline
CID 129174821
(2R)-N-(furan-2-ylmethyl)-2-phenyl-N-[[4-[5-[[[(2S)-2-phenyl-2-(quinolin-6-ylsulfanylamino)acetyl]-(thiophen-2-ylmethyl)amino]methyl]furan-3-yl]thiophen-2-yl]methyl]-2-(quinolin-6-ylsulfanylamino)acetamide
CID 129227446
4-[5-[5-[(1-adamantylamino)methyl]-2-pyridinyl]furan-3-yl]-N-[(6-thiophen-3-yl-3-pyridinyl)methyl]adamantan-1-amine
CID 134232448
1-[6-(furan-2-yl)-4-(1H-indol-2-yl)-2-pyrazin-2-yl-5-thiophen-2-yl-3-pyridinyl]-2H-isoindole
CID 140970254
1-anthracen-1-yl-4-(furan-2-yl)-4-naphthalen-1-yl-5-naphthalen-2-yl-2-phenanthren-1-yl-5-(3-phenyl-1H-pyrrol-2-yl)-3-thiophen-2-yltriazolidine
CID 140985956
2-[6-(furan-2-yl)-2-pyridin-2-yl-4-(1H-pyrrol-2-yl)-5-thiophen-2-yl-3-pyridinyl]quinoline
CID 141095880
3-(Furan-2-yl)-4-piperidin-1-yl-2-pyridin-2-yl-2-quinolin-2-yl-3-thiophen-2-ylmorpholine
CID 141098916
5-(furan-3-yl)-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-7H-cyclopenta[b]pyridine;methyl-methylidene-[5-[3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-7H-cyclopenta[b]pyridin-5-yl]-2-pyridinyl]-oxo-lambda6-sulfane;4-[[5-[3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-7H-cyclopenta[b]pyridin-5-yl]thiophen-2-yl]methyl]morpholine;3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-(1-methylpyrrol-3-yl)-7H-cyclopenta[b]pyridine
CID 157069519

Frequently Asked Questions

What is the IUPAC name of N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine?
The IUPAC name of N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine (CID 159840209) is N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine.
What is the SMILES notation for N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine?
The canonical SMILES for N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine is c1cc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)cs1.c1ccc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)cc1.c1ccc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)nc1.c1ccc2nc(CNC34CC5CC(CC(C5)C3)C4)ccc2c1.c1coc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)c1.c1coc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)c1.c1csc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cc2)c1.c1csc(-c2ccc(CNC34CC5CC(CC(C5)C3)C4)cn2)c1.
What is the InChIKey of N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine?
The InChIKey is NOOUFEUVUMOCNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2.C21H25N3.C21H25NO.2C21H25NS.C20H24N2O.C20H24N2S.C20H24N2/c1-2-4-20(5-3-1)21-7-6-16(14-23-21)15-24-22-11-17-8-18(12-22)10-19(9-17)13-22;1-2-6-22-19(3-1)20-5-4-15(13-23-20)14-24-21-10-16-7-17(11-21)9-18(8-16)12-21;1-2-20(23-7-1)19-5-3-15(4-6-19)14-22-21-11-16-8-17(12-21)10-18(9-16)13-21;1-3-19(20-5-6-23-14-20)4-2-15(1)13-22-21-10-16-7-17(11-21)9-18(8-16)12-21;1-2-20(23-7-1)19-5-3-15(4-6-19)14-22-21-11-16-8-17(12-21)10-18(9-16)13-21;2*1-2-19(23-5-1)18-4-3-14(12-21-18)13-22-20-9-15-6-16(10-20)8-17(7-15)11-20;1-2-4-19-17(3-1)5-6-18(22-19)13-21-20-10-14-7-15(11-20)9-16(8-14)12-20/h1-7,14,17-19,24H,8-13,15H2;1-6,13,16-18,24H,7-12,14H2;1-7,16-18,22H,8-14H2;1-6,14,16-18,22H,7-13H2;1-7,16-18,22H,8-14H2;2*1-5,12,15-17,22H,6-11,13H2;1-6,14-16,21H,7-13H2.
What are the key properties of N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine?
N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine has a molecular weight of 2517.71 g/mol, XLogP of 38.52, 31 rotatable bonds, 8 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(furan-2-yl)phenyl]methyl]adamantan-1-amine;N-[[6-(furan-2-yl)-3-pyridinyl]methyl]adamantan-1-amine;N-[(6-phenyl-3-pyridinyl)methyl]adamantan-1-amine;N-[(6-pyridin-2-yl-3-pyridinyl)methyl]adamantan-1-amine;N-(quinolin-2-ylmethyl)adamantan-1-amine;N-[(4-thiophen-2-ylphenyl)methyl]adamantan-1-amine;N-[(4-thiophen-3-ylphenyl)methyl]adamantan-1-amine;N-[(6-thiophen-2-yl-3-pyridinyl)methyl]adamantan-1-amine is sourced from PubChem (CID 159840209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).