N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide

C102H122N10O8 — CID 158969784

IUPACN-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide
SMILESCC(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(C(C)(C)O)cc1.CC(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(C(C)C)cc1.CC(=O)Nc1ccc2c(c1)CCN2Cc1ccc(C(C)(C)O)cc1.CC(=O)Nc1ccc2c(c1)CCN2Cc1ccc(C(C)C)cc1.CC(=O)Nc1ccc2c(ccn2Cc2ccc(C(C)(C)O)cc2)c1
InChIInChI=1S/C21H26N2O2.C21H26N2O.C20H24N2O2.C20H22N2O2.C20H24N2O/c1-15(24)22-19-10-11-20-17(13-19)5-4-12-23(20)14-16-6-8-18(9-7-16)21(2,3)25;1-15(2)18-8-6-17(7-9-18)14-23-12-4-5-19-13-20(22-16(3)24)10-11-21(19)23;2*1-14(23)21-18-8-9-19-16(12-18)10-11-22(19)13-15-4-6-17(7-5-15)20(2,3)24;1-14(2)17-6-4-16(5-7-17)13-22-11-10-18-12-19(21-15(3)23)8-9-20(18)22/h6-11,13,25H,4-5,12,14H2,1-3H3,(H,22,24);6-11,13,15H,4-5,12,14H2,1-3H3,(H,22,24);4-9,12,24H,10-11,13H2,1-3H3,(H,21,23);4-12,24H,13H2,1-3H3,(H,21,23);4-9,12,14H,10-11,13H2,1-3H3,(H,21,23)
InChIKeyJNQSYGIQSULKBJ-UHFFFAOYSA-N
MW1616.16 g/mol
LogP20.19
Rot. Bonds20

About N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide

N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide (PubChem CID 158969784) has the molecular formula C102H122N10O8 and a molecular weight of 1616.16 g/mol. Its IUPAC name is N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide.

Molecular Properties

Compound NameN-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide
PubChem CID158969784
Molecular FormulaC102H122N10O8
Molecular Weight1616.16 g/mol
Exact Mass1614.94
IUPAC NameN-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide
SMILESCC(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(C(C)(C)O)cc1.CC(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(C(C)C)cc1.CC(=O)Nc1ccc2c(c1)CCN2Cc1ccc(C(C)(C)O)cc1.CC(=O)Nc1ccc2c(c1)CCN2Cc1ccc(C(C)C)cc1.CC(=O)Nc1ccc2c(ccn2Cc2ccc(C(C)(C)O)cc2)c1
InChIInChI=1S/C21H26N2O2.C21H26N2O.C20H24N2O2.C20H22N2O2.C20H24N2O/c1-15(24)22-19-10-11-20-17(13-19)5-4-12-23(20)14-16-6-8-18(9-7-16)21(2,3)25;1-15(2)18-8-6-17(7-9-18)14-23-12-4-5-19-13-20(22-16(3)24)10-11-21(19)23;2*1-14(23)21-18-8-9-19-16(12-18)10-11-22(19)13-15-4-6-17(7-5-15)20(2,3)24;1-14(2)17-6-4-16(5-7-17)13-22-11-10-18-12-19(21-15(3)23)8-9-20(18)22/h6-11,13,25H,4-5,12,14H2,1-3H3,(H,22,24);6-11,13,15H,4-5,12,14H2,1-3H3,(H,22,24);4-9,12,24H,10-11,13H2,1-3H3,(H,21,23);4-12,24H,13H2,1-3H3,(H,21,23);4-9,12,14H,10-11,13H2,1-3H3,(H,21,23)
InChIKeyJNQSYGIQSULKBJ-UHFFFAOYSA-N
XLogP20.19
TPSA224.08 Ų
H-Bond Donors8
H-Bond Acceptors13
Rotatable Bonds20
Heavy Atoms120
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001616.16
LogP ≤ 520.19
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide?
The IUPAC name of N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide (CID 158969784) is N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide.
What is the SMILES notation for N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide?
The canonical SMILES for N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide is CC(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(C(C)(C)O)cc1.CC(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(C(C)C)cc1.CC(=O)Nc1ccc2c(c1)CCN2Cc1ccc(C(C)(C)O)cc1.CC(=O)Nc1ccc2c(c1)CCN2Cc1ccc(C(C)C)cc1.CC(=O)Nc1ccc2c(ccn2Cc2ccc(C(C)(C)O)cc2)c1.
What is the InChIKey of N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide?
The InChIKey is JNQSYGIQSULKBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2.C21H26N2O.C20H24N2O2.C20H22N2O2.C20H24N2O/c1-15(24)22-19-10-11-20-17(13-19)5-4-12-23(20)14-16-6-8-18(9-7-16)21(2,3)25;1-15(2)18-8-6-17(7-9-18)14-23-12-4-5-19-13-20(22-16(3)24)10-11-21(19)23;2*1-14(23)21-18-8-9-19-16(12-18)10-11-22(19)13-15-4-6-17(7-5-15)20(2,3)24;1-14(2)17-6-4-16(5-7-17)13-22-11-10-18-12-19(21-15(3)23)8-9-20(18)22/h6-11,13,25H,4-5,12,14H2,1-3H3,(H,22,24);6-11,13,15H,4-5,12,14H2,1-3H3,(H,22,24);4-9,12,24H,10-11,13H2,1-3H3,(H,21,23);4-12,24H,13H2,1-3H3,(H,21,23);4-9,12,14H,10-11,13H2,1-3H3,(H,21,23).
What are the key properties of N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide?
N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide has a molecular weight of 1616.16 g/mol, XLogP of 20.19, 20 rotatable bonds, 8 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide;N-[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]indol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-2,3-dihydroindol-5-yl]acetamide;N-[1-[(4-propan-2-ylphenyl)methyl]-3,4-dihydro-2H-quinolin-6-yl]acetamide is sourced from PubChem (CID 158969784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).