2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine

C24H26N2 — CID 139663457

IUPAC2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine
SMILESCC(C)c1ccc(Nc2cc(-c3ccccc3)nc3c2CCCC3)cc1
InChIInChI=1S/C24H26N2/c1-17(2)18-12-14-20(15-13-18)25-24-16-23(19-8-4-3-5-9-19)26-22-11-7-6-10-21(22)24/h3-5,8-9,12-17H,6-7,10-11H2,1-2H3,(H,25,26)
InChIKeyGUSWEGQWCKHUIX-UHFFFAOYSA-N
MW342.49 g/mol
LogP6.49
Rot. Bonds4

About 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine

2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine (PubChem CID 139663457) has the molecular formula C24H26N2 and a molecular weight of 342.49 g/mol. Its IUPAC name is 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine.

Molecular Properties

Compound Name2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine
PubChem CID139663457
Molecular FormulaC24H26N2
Molecular Weight342.49 g/mol
Exact Mass342.21
IUPAC Name2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine
SMILESCC(C)c1ccc(Nc2cc(-c3ccccc3)nc3c2CCCC3)cc1
InChIInChI=1S/C24H26N2/c1-17(2)18-12-14-20(15-13-18)25-24-16-23(19-8-4-3-5-9-19)26-22-11-7-6-10-21(22)24/h3-5,8-9,12-17H,6-7,10-11H2,1-2H3,(H,25,26)
InChIKeyGUSWEGQWCKHUIX-UHFFFAOYSA-N
XLogP6.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.49
LogP ≤ 56.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-N-[4-(2-methylpropyl)phenyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
CID 131966721
4-chloro-2-phenyl-5,6,7,8-tetrahydroquinoline
CID 12798312
1-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]-2-nitrosoethanol
CID 156544016
4-chloro-2-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 118037090
3-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]propan-1-ol;hydrochloride
CID 118037249
2-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]acetohydrazide
CID 163659362
4-(4-methylphenyl)-2-phenyl-5,6,7,8-tetrahydroquinoline
CID 3321214
methyl 2-[4-[[2-(3-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenoxy]acetate
CID 90112439
1-[4-[[2-(5-chloro-3-pyridinyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]propan-2-one
CID 161151882
4-(4-methylpiperazin-1-yl)-6-phenyl-N-(4-propan-2-ylphenyl)pyrimidin-2-amine
CID 112936303
2-[4-[[2-(3-chloro-5-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl]amino]phenyl]ethanol;hydrochloride
CID 90110516
4-(4-methoxyphenyl)-2-phenyl-5,6,7,8-tetrahydroquinoline
CID 13010672

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine?
The IUPAC name of 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine (CID 139663457) is 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine.
What is the SMILES notation for 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine?
The canonical SMILES for 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine is CC(C)c1ccc(Nc2cc(-c3ccccc3)nc3c2CCCC3)cc1.
What is the InChIKey of 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine?
The InChIKey is GUSWEGQWCKHUIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2/c1-17(2)18-12-14-20(15-13-18)25-24-16-23(19-8-4-3-5-9-19)26-22-11-7-6-10-21(22)24/h3-5,8-9,12-17H,6-7,10-11H2,1-2H3,(H,25,26).
What are the key properties of 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine?
2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine has a molecular weight of 342.49 g/mol, XLogP of 6.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(4-propan-2-ylphenyl)-5,6,7,8-tetrahydroquinolin-4-amine is sourced from PubChem (CID 139663457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).